PURINOSTAT MESYLATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H26N10O3.CH4O3S
Molecular Weight	586.623
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CS(O)(=O)=O.CN(CC1=NC2=C(N=C(N=C2N1C)C3=CC=C(N)C=C3)N4CCOCC4)C5=NC=C(C=N5)C(=O)NO

InChI

InChIKey=QTSZBNQPNSJXAC-UHFFFAOYSA-N

InChI=1S/C23H26N10O3.CH4O3S/c1-31(23-25-11-15(12-26-23)22(34)30-35)13-17-27-18-20(32(17)2)28-19(14-3-5-16(24)6-4-14)29-21(18)33-7-9-36-10-8-33;1-5(2,3)4/h3-6,11-12,35H,7-10,13,24H2,1-2H3,(H,30,34);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula	C23H26N10O3
Molecular Weight	490.5177
Charge	0
Count

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

Molecular Formula	CH4O3S
Molecular Weight	96.106
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 18:02:06 GMT 2023` Edited by `admin` on `Sat Dec 16 18:02:06 GMT 2023`
Record UNII	WP897GX44U
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PURINOSTAT MESYLATE

Common Name

English

5-PYRIMIDINECARBOXAMIDE, 2-(((2-(4-AMINOPHENYL)-9-METHYL-6-(4-MORPHOLINYL)-9H-PURIN-8-YL)METHYL)METHYLAMINO)-N-HYDROXY-, MESYLATE

Systematic Name

English

2-(((2-(4-AMINOPHENYL)-9-METHYL-6-(4-MORPHOLINYL)-9H-PURIN-8-YL)METHYL)METHYLAMINO)-N-HYDROXY-5-PYRIMIDINECARBOXAMIDE, MESYLATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

127044510

Created by admin on Sat Dec 16 18:02:07 GMT 2023 , Edited by admin on Sat Dec 16 18:02:07 GMT 2023

PRIMARY

FDA UNII

WP897GX44U

Created by admin on Sat Dec 16 18:02:07 GMT 2023 , Edited by admin on Sat Dec 16 18:02:07 GMT 2023

PRIMARY

NCI_THESAURUS

C192177

Created by admin on Sat Dec 16 18:02:07 GMT 2023 , Edited by admin on Sat Dec 16 18:02:07 GMT 2023

PRIMARY

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