RP-100798

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H19N3O3
Molecular Weight	361.3939
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)OC1=C(C=C(C=C1)C2=NC(=NO2)C3=C4CC[C@H](O)C4=CC=C3)C#N

InChI

InChIKey=KOBRJNRHIIDYMK-SFHVURJKSA-N

InChI=1S/C21H19N3O3/c1-12(2)26-19-9-6-13(10-14(19)11-22)21-23-20(24-27-21)17-5-3-4-16-15(17)7-8-18(16)25/h3-6,9-10,12,18,25H,7-8H2,1-2H3/t18-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H19N3O3
Molecular Weight	361.3939
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 16:36:41 GMT 2023` Edited by `admin` on `Sat Dec 16 16:36:41 GMT 2023`
Record UNII	KYS7WW026H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RP-100798

Code

English

5-(3-((1S)-2,3-DIHYDRO-1-HYDROXY-1H-INDEN-4-YL)-1,2,4-OXADIAZOL-5-YL)-2-(1-METHYLETHOXY)BENZONITRILE

Systematic Name

English

BENZONITRILE, 5-(3-((1S)-2,3-DIHYDRO-1-HYDROXY-1H-INDEN-4-YL)-1,2,4-OXADIAZOL-5-YL)-2-(1-METHYLETHOXY)-

Systematic Name

English

RP100798

Code

English

CC1084037

Code

English

Code System Code Type Description

PUBCHEM

52939050

Created by admin on Sat Dec 16 16:36:41 GMT 2023 , Edited by admin on Sat Dec 16 16:36:41 GMT 2023

PRIMARY

FDA UNII

KYS7WW026H

Created by admin on Sat Dec 16 16:36:41 GMT 2023 , Edited by admin on Sat Dec 16 16:36:41 GMT 2023

PRIMARY

CAS

1306760-60-0

Created by admin on Sat Dec 16 16:36:41 GMT 2023 , Edited by admin on Sat Dec 16 16:36:41 GMT 2023

PRIMARY

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Biological Half-life	PHARMACOKINETIC