BMS-922755

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H25F2N5O4
Molecular Weight	533.526
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

FC1=C(F)C(=CC=C1)[C@@H]2CC[C@@H](OC(=O)N3CCC(CC3)N4C(=O)NC5=C4C=CC=N5)C6=C(C=CC=N6)C2=O

InChI

InChIKey=WLJCNLRHCYLSIH-PGRDOPGGSA-N

InChI=1S/C28H25F2N5O4/c29-20-6-1-4-17(23(20)30)18-8-9-22(24-19(25(18)36)5-2-12-31-24)39-28(38)34-14-10-16(11-15-34)35-21-7-3-13-32-26(21)33-27(35)37/h1-7,12-13,16,18,22H,8-11,14-15H2,(H,32,33,37)/t18-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H25F2N5O4
Molecular Weight	533.526
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 `Sat Dec 16 16:36:23 GMT 2023` Edited by `admin` on `Sat Dec 16 16:36:23 GMT 2023`
Record UNII	RTN356FC1D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BMS-922755

Common Name

English

1-PIPERIDINECARBOXYLIC ACID, 4-(2,3-DIHYDRO-2-OXO-1H-IMIDAZO(4,5-B)PYRIDIN-1-YL)-, (6S,9R)-6-(2,3-DIFLUOROPHENYL)-6,7,8,9-TETRAHYDRO-5-OXO-5H-CYCLOHEPTA(B)PYRIDIN-9-YL ESTER

Systematic Name

English

RIMEGEPANT METABOLITE M26

Common Name

English

Code System Code Type Description

CAS

1413936-28-3

Created by admin on Sat Dec 16 16:36:23 GMT 2023 , Edited by admin on Sat Dec 16 16:36:23 GMT 2023

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PUBCHEM

51357583

Created by admin on Sat Dec 16 16:36:23 GMT 2023 , Edited by admin on Sat Dec 16 16:36:23 GMT 2023

PRIMARY

FDA UNII

RTN356FC1D

Created by admin on Sat Dec 16 16:36:23 GMT 2023 , Edited by admin on Sat Dec 16 16:36:23 GMT 2023

PRIMARY

Related Record Type Details


					997WVV895X

RIMEGEPANT

PARENT -> METABOLITE

Amount: