Suvorexant, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H23ClN6O2
Molecular Weight	450.921
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@H]1CCN(CCN1C(=O)C2=CC(C)=CC=C2N3N=CC=N3)C4=NC5=C(O4)C=CC(Cl)=C5

InChI

InChIKey=JYTNQNCOQXFQPK-INIZCTEOSA-N

InChI=1S/C23H23ClN6O2/c1-15-3-5-20(30-25-8-9-26-30)18(13-15)22(31)29-12-11-28(10-7-16(29)2)23-27-19-14-17(24)4-6-21(19)32-23/h3-6,8-9,13-14,16H,7,10-12H2,1-2H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H23ClN6O2
Molecular Weight	450.921
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 `Wed Apr 02 20:19:49 GMT 2025` Edited by `admin` on `Wed Apr 02 20:19:49 GMT 2025`
Record UNII	RG9V4Z2QSY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-Chloro-2-[(5S)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl]-1,3-benzoxazole

Preferred Name

English

Suvorexant, (S)-

Common Name

English

[(7S)-4-(5-Chloro-2-benzoxazolyl)hexahydro-7-methyl-1H-1,4-diazepin-1-yl][5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl]methanone

Systematic Name

English

Code System Code Type Description

FDA UNII

RG9V4Z2QSY

Created by admin on Wed Apr 02 20:19:49 GMT 2025 , Edited by admin on Wed Apr 02 20:19:49 GMT 2025

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PUBCHEM

67173813

Created by admin on Wed Apr 02 20:19:49 GMT 2025 , Edited by admin on Wed Apr 02 20:19:49 GMT 2025

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