Zelasudil

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H21F2N7O
Molecular Weight	437.4452
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN1N=C(N=C1NC2=CC=C3NN=CC3=C2C4CC4)C5=CC=C(C=C5)C(=O)NCC(F)F

InChI

InChIKey=HSZPZEGJQCFGDE-UHFFFAOYSA-N

InChI=1S/C22H21F2N7O/c1-31-22(27-17-9-8-16-15(10-26-29-16)19(17)12-2-3-12)28-20(30-31)13-4-6-14(7-5-13)21(32)25-11-18(23)24/h4-10,12,18H,2-3,11H2,1H3,(H,25,32)(H,26,29)(H,27,28,30)

HIDE SMILES / InChI

Molecular Formula	C22H21F2N7O
Molecular Weight	437.4452
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 19:19:37 UTC 2023` Edited by `admin` on `Sat Dec 16 19:19:37 UTC 2023`
Record UNII	EEF2SY7GG2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Zelasudil

Official Name

English

zelasudil [INN]

Common Name

English

4-{5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl- 1H-1,2,4-triazol-3-yl}-N-(2,2-difluoroethyl)benzamide

Systematic Name

English

Benzamide, 4-[5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1H-1,2,4-triazol-3-yl]-N-(2,2-difluoroethyl)-

Systematic Name

English

4-[5-[(4-Cyclopropyl-1H-indazol-5-yl)amino]-1-methyl-1H-1,2,4-triazol-3-yl]-N-(2,2-difluoroethyl)benzamide

Systematic Name

English

4-{5-[(4-cyclopropyl-1H-indazol-5-yl)amino]-1-methyl- 1H-1,2,4-triazol-3-yl}-N-(2,2-difluoroethyl)benzamide

Systematic Name

English

Code System Code Type Description

PUBCHEM

155792249