TAK-960

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H34F3N7O3
Molecular Weight	561.5992
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=C(NC2=NC=C3N(C)C(=O)C(F)(F)CN(C4CCCC4)C3=N2)C=C(F)C(=C1)C(=O)NC5CCN(C)CC5

InChI

InChIKey=GWRSATNRNFYMDI-UHFFFAOYSA-N

InChI=1S/C27H34F3N7O3/c1-35-10-8-16(9-11-35)32-24(38)18-12-22(40-3)20(13-19(18)28)33-26-31-14-21-23(34-26)37(17-6-4-5-7-17)15-27(29,30)25(39)36(21)2/h12-14,16-17H,4-11,15H2,1-3H3,(H,32,38)(H,31,33,34)

HIDE SMILES / InChI

Molecular Formula	C27H34F3N7O3
Molecular Weight	561.5992
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 08:24:38 UTC 2023` Edited by `admin` on `Sat Dec 16 08:24:38 UTC 2023`
Record UNII	3831VFM1ZB
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TAK-960

Code

English

TAK960

Code

English

4-((9-CYCLOPENTYL-7,7-DIFLUORO-6,7,8,9-TETRAHYDRO-5-METHYL-6-OXO-5H-PYRIMIDO(4,5-B)(1,4)DIAZEPIN-2-YL)AMINO)-2-FLUORO-5-METHOXY-N-(1-METHYL-4-PIPERIDINYL)BENZAMIDE

Systematic Name

English

BENZAMIDE, 4-((9-CYCLOPENTYL-7,7-DIFLUORO-6,7,8,9-TETRAHYDRO-5-METHYL-6-OXO-5H-PYRIMIDO(4,5-B)(1,4)DIAZEPIN-2-YL)AMINO)-2-FLUORO-5-METHOXY-N-(1-METHYL-4-PIPERIDINYL)-

Systematic Name

English

Code System Code Type Description

CAS

1137868-52-0