Iscartrelvir

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H24BrN5O4
Molecular Weight	526.382
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CNC(=O)C1=CC(Br)=CC(=C1N[C@@H]2CCCC[C@@H]2NC(=O)C3=C4C=CC=CC4=CN=C3)[N+]([O-])=O

InChI

InChIKey=BPLNOSFMIIASSJ-UXHICEINSA-N

InChI=1S/C24H24BrN5O4/c1-26-23(31)17-10-15(25)11-21(30(33)34)22(17)28-19-8-4-5-9-20(19)29-24(32)18-13-27-12-14-6-2-3-7-16(14)18/h2-3,6-7,10-13,19-20,28H,4-5,8-9H2,1H3,(H,26,31)(H,29,32)/t19-,20+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C24H24BrN5O4
Molecular Weight	526.382
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 `Wed Apr 02 14:20:03 GMT 2025` Edited by `admin` on `Wed Apr 02 14:20:03 GMT 2025`
Record UNII	W2LTV65R5E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Iscartrelvir

Official Name

English

iscartrelvir [INN]

Preferred Name

English

N-((1S,2R)-2-((4-bromo-2-(methylcarbamoyl)-6-nitrophenyl)amino)cyclohexyl)isoquinoline-4-carboxamide

Systematic Name

English

4-Isoquinolinecarboxamide, N-[(1S,2R)-2-[[4-bromo-2-[(methylamino)carbonyl]-6-nitrophenyl]amino]cyclohexyl]-

Systematic Name

English

Code System Code Type Description

FDA UNII

W2LTV65R5E