DASANTAFIL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H28BrN5O5
Molecular Weight	522.392
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCN1C(=O)N(CCO)C2=C(N(CC3=CC(Br)=C(OC)C=C3)C(N[C@@H]4CCC[C@H]4O)=N2)C1=O

InChI

InChIKey=RCJYGWGQCPDYSL-HZPDHXFCSA-N

InChI=1S/C22H28BrN5O5/c1-3-26-20(31)18-19(27(9-10-29)22(26)32)25-21(24-15-5-4-6-16(15)30)28(18)12-13-7-8-17(33-2)14(23)11-13/h7-8,11,15-16,29-30H,3-6,9-10,12H2,1-2H3,(H,24,25)/t15-,16-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H28BrN5O5
Molecular Weight	522.392
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:47:23 UTC 2023` Edited by `admin` on `Sat Dec 16 16:47:23 UTC 2023`
Record UNII	48P711MI2G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DASANTAFIL

Official Name

English

1H-PURINE-2,6-DIONE, 7-((3-BROMO-4-METHOXYPHENYL)METHYL)-1-ETHYL-3,7-DIHYDRO-8-(((1R,2R)-2-HYDROXYCYCLOPENTYL)AMINO)-3-(2-HYDROXYETHYL)

Common Name

English

SCH446132

Code

English

DASANTAFIL [USAN]

Common Name

English

SCH-446132

Code

English

dasantafil [INN]

Common Name

English

7-(3-Bromo-4-methoxybenzyl)-1-ethyl-8-[[(1R,2R)-2-hydroxycyclopentyl]amino]-3-(2-hydroxyethyl)-3,7-dihydro-1H-purine-2,6-dione

Systematic Name

English

Dasantafil [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C2127

Created by admin on Sat Dec 16 16:47:24 UTC 2023 , Edited by admin on Sat Dec 16 16:47:24 UTC 2023

Code System Code Type Description

ChEMBL

CHEMBL2107326

Created by admin on Sat Dec 16 16:47:23 UTC 2023 , Edited by admin on Sat Dec 16 16:47:23 UTC 2023

PRIMARY

PUBCHEM

9871410

Created by admin on Sat Dec 16 16:47:24 UTC 2023 , Edited by admin on Sat Dec 16 16:47:24 UTC 2023

PRIMARY

SMS_ID

300000034103

Created by admin on Sat Dec 16 16:47:24 UTC 2023 , Edited by admin on Sat Dec 16 16:47:24 UTC 2023

PRIMARY

NCI_THESAURUS

C76888

Created by admin on Sat Dec 16 16:47:24 UTC 2023 , Edited by admin on Sat Dec 16 16:47:24 UTC 2023

PRIMARY

INN

8485

Created by admin on Sat Dec 16 16:47:23 UTC 2023 , Edited by admin on Sat Dec 16 16:47:23 UTC 2023

PRIMARY

CAS

569351-91-3

Created by admin on Sat Dec 16 16:47:23 UTC 2023 , Edited by admin on Sat Dec 16 16:47:23 UTC 2023

PRIMARY

USAN

PP-55

Created by admin on Sat Dec 16 16:47:24 UTC 2023 , Edited by admin on Sat Dec 16 16:47:24 UTC 2023

PRIMARY

FDA UNII

48P711MI2G

Created by admin on Sat Dec 16 16:47:23 UTC 2023 , Edited by admin on Sat Dec 16 16:47:23 UTC 2023

PRIMARY

EPA CompTox

DTXSID30205480

Created by admin on Sat Dec 16 16:47:23 UTC 2023 , Edited by admin on Sat Dec 16 16:47:23 UTC 2023

PRIMARY

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Related Record Type Details


					48P711MI2G

DASANTAFIL

ACTIVE MOIETY

Amount: