BRANEBRUTINIB

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H23FN4O2
Molecular Weight	370.4206
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BRANEBRUTINIB

Structure Search

SMILES

CC#CC(=O)N[C@H]1CCCN(C1)C2=C3C(C)=C(C)NC3=C(C=C2F)C(N)=O

InChI

InChIKey=VJPPLCNBDLZIFG-ZDUSSCGKSA-N

InChI=1S/C20H23FN4O2/c1-4-6-16(26)24-13-7-5-8-25(10-13)19-15(21)9-14(20(22)27)18-17(19)11(2)12(3)23-18/h9,13,23H,5,7-8,10H2,1-3H3,(H2,22,27)(H,24,26)/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H23FN4O2
Molecular Weight	370.4206
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 13:32:21 GMT 2023` Edited by `admin` on `Sat Dec 16 13:32:21 GMT 2023`
Record UNII	7LBRZUYSHU
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

BRANEBRUTINIB

Official Name

English

branebrutinib [INN]

Common Name

English

BMS-986195

Code

English

BRANEBRUTINIB [USAN]

Common Name

English

1H-INDOLE-7-CARBOXAMIDE, 5-FLUORO-2,3-DIMETHYL-4-((3S)-3-((1-OXO-2-BUTYN-1-YL)AMINO)-1-PIPERIDINYL)-

Systematic Name

English

(S)-4-(3-(2-BUTYNOYLAMINO)PIPERIDIN-1-YL)-5-FLUORO-2,3-DIMETHYL-1H-INDOLE-7-CARBOXAMIDE

Systematic Name

English

Branebrutinib [WHO-DD]

Common Name

English

4-((3S)-3-(2-BUTYNOYLAMINO)-1-PIPERIDINYL)-5-FLUORO-2,3-DIMETHYL-1HINDOLE-7-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

DRUG BANK

DB15347

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

INN

11026

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

PUBCHEM

121293929

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

NCI_THESAURUS

C167033

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

FDA UNII

7LBRZUYSHU

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

SMS_ID

300000038099

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

USAN

FG-21

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

CAS

1912445-55-6

Created by admin on Sat Dec 16 13:32:24 GMT 2023 , Edited by admin on Sat Dec 16 13:32:24 GMT 2023

PRIMARY

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