NINTEDANIB ESYLATE

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C31H33N5O4.C2H6O3S
Molecular Weight	649.757
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of NINTEDANIB ESYLATE

Structure Search

SMILES

CCS(O)(=O)=O.COC(=O)C1=CC2=C(C=C1)\C(C(=O)N2)=C(\NC3=CC=C(C=C3)N(C)C(=O)CN4CCN(C)CC4)C5=CC=CC=C5

InChI

InChIKey=MMMVNAGRWOJNMW-FJBFXRHMSA-N

InChI=1S/C31H33N5O4.C2H6O3S/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38;1-2-6(3,4)5/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38);2H2,1H3,(H,3,4,5)/b29-28-;

HIDE SMILES / InChI

Molecular Formula	C31H33N5O4
Molecular Weight	539.6248
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Molecular Formula	C2H6O3S
Molecular Weight	110.132
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:27:15 UTC 2023` Edited by `admin` on `Sat Dec 16 19:27:15 UTC 2023`
Record UNII	42F62RTZ4G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NINTEDANIB ESYLATE

Official Name

English

METHYL (3Z)-3-(((4-(N-METHYL-2-(4-METHYLPIPERAZIN-1-YL)ACETAMIDO)PHENYL)AMINO) (PHENYL)METHYLIDENE)-2-OXO-2,3-DIHYDRO-1H-INDOLE-6-CARBOXYLATE ETHANESULFONATE

Systematic Name

English

NINTEDANIB ETHANESULFONATE

Common Name

English

NINTEDANIB ESYLATE [ORANGE BOOK]

Common Name

English

NINTEDANIB ESYLATE [USAN]

Common Name

English

NINTEDANIB ESILATE

Common Name

English

NINTEDANIB ETHANESULFONATE [JAN]

Common Name

English

Nintedanib esilate [WHO-DD]

Common Name

English

OFEV

Brand Name

English

Classification Tree Code System Code

NCI_THESAURUS

C1742

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

NCI_THESAURUS

C155727

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

Code System Code Type Description

USAN

ZZ-50

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

PUBCHEM

9809714

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

SMS_ID

100000165804

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

DAILYMED

42F62RTZ4G

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

CHEBI

85170

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

EPA CompTox

DTXSID40215873

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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JAPANESE REVIEW

OFEV

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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APPROVED JULY 2015

NCI_THESAURUS

C154570

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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CAS

656247-18-6

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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RXCUI

1592736

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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RxNorm

FDA UNII

42F62RTZ4G

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

EVMPD

SUB179667

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

DRUG BANK

DBSALT001111

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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MESH

C530716

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

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ChEMBL

CHEMBL502835

Created by admin on Sat Dec 16 19:27:16 UTC 2023 , Edited by admin on Sat Dec 16 19:27:16 UTC 2023

PRIMARY

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