TANDUTINIB SULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C31H42N6O4.H2O4S
Molecular Weight	660.781
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OS(O)(=O)=O.COC1=C(OCCCN2CCCCC2)C=C3N=CN=C(N4CCN(CC4)C(=O)NC5=CC=C(OC(C)C)C=C5)C3=C1

InChI

InChIKey=FXCQXNUGIYMXAR-UHFFFAOYSA-N

InChI=1S/C31H42N6O4.H2O4S/c1-23(2)41-25-10-8-24(9-11-25)34-31(38)37-17-15-36(16-18-37)30-26-20-28(39-3)29(21-27(26)32-22-33-30)40-19-7-14-35-12-5-4-6-13-35;1-5(2,3)4/h8-11,20-23H,4-7,12-19H2,1-3H3,(H,34,38);(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula	H2O4S
Molecular Weight	98.078
Charge	0
Count

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

Molecular Formula	C31H42N6O4
Molecular Weight	562.703
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 `Fri Dec 15 15:31:19 UTC 2023` Edited by `admin` on `Fri Dec 15 15:31:19 UTC 2023`
Record UNII	T7Q9I8CGQ7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TANDUTINIB SULFATE

Common Name

English

CT-53518 SULPHATE

Common Name

English

1-PIPERAZINECARBOXAMIDE, 4-(6-METHOXY-7-(3-(1-PIPERIDINYL)PROPOXY)-4-QUINAZOLINYL)-N-(4-(1-METHYLETHOXY)PHENYL)-, SULFATE (1:1)

Systematic Name

English

TANDUTINIB SULPHATE

Common Name

English

CT-53518 SULFATE

Code

English

Code System Code Type Description

CAS

387867-14-3

Created by admin on Fri Dec 15 15:31:19 UTC 2023 , Edited by admin on Fri Dec 15 15:31:19 UTC 2023

PRIMARY

PUBCHEM

12002085

Created by admin on Fri Dec 15 15:31:19 UTC 2023 , Edited by admin on Fri Dec 15 15:31:19 UTC 2023

PRIMARY

FDA UNII

T7Q9I8CGQ7

Created by admin on Fri Dec 15 15:31:19 UTC 2023 , Edited by admin on Fri Dec 15 15:31:19 UTC 2023

PRIMARY

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