VORNOREXANT

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H22FN7O2
Molecular Weight	447.4649
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC(C(=O)N2CCCO[C@H]2CN3C=CC(=N3)C4=CC=C(F)C=N4)=C(C=C1)N5N=CC=N5

InChI

InChIKey=AEZZJXJIJFSUEM-QFIPXVFZSA-N

InChI=1S/C23H22FN7O2/c1-16-3-6-21(31-26-8-9-27-31)18(13-16)23(32)30-10-2-12-33-22(30)15-29-11-7-20(28-29)19-5-4-17(24)14-25-19/h3-9,11,13-14,22H,2,10,12,15H2,1H3/t22-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H22FN7O2
Molecular Weight	447.4649
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 16:23:13 UTC 2023` Edited by `admin` on `Sat Dec 16 16:23:13 UTC 2023`
Record UNII	ZY54BP1CK3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VORNOREXANT

Official Name

English

vornorexant [INN]

Common Name

English

ORN0829

Code

English

((2S)-2-((3-(5-FLUOROPYRIDIN-2-YL)-1H-PYRAZOL-1-YL)METHYL)-1,3-OXAZINAN-3-YL)(5-METHYL-2-(2H-1,2,3-TRIAZOL-2-YL)PHENYL)METHANONE

Systematic Name

English

METHANONE, ((2S)-2-((3-(5-FLUORO-2-PYRIDINYL)-1H-PYRAZOL-1-YL)METHYL)DIHYDRO-2H-1,3-OXAZIN-3(4H)-YL)(5-METHYL-2-(2H-1,2,3-TRIAZOL-2-YL)PHENYL)-

Systematic Name

English

ORN-0829

Code

English

Code System Code Type Description

NCI_THESAURUS

C186417