(S)-N-(1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)-1-((4-HYDROXYCYCLOHEXYL)METHYL)-1H-INDAZOLE-3-CARBOXAMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C20H28N4O3
Molecular Weight	372.4613
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0
Stereo Comments	Unspecified cis-trans substitution

SHOW SMILES / InChI

Structure of (S)-N-(1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)-1-((4-HYDROXYCYCLOHEXYL)METHYL)-1H-INDAZOLE-3-CARBOXAMIDE

Structure Search

SMILES

CC(C)[C@H](NC(=O)C1=NN(CC2CCC(O)CC2)C3=C1C=CC=C3)C(N)=O

InChI

InChIKey=GAXQKKYBSIFRJX-KVULBXGLSA-N

InChI=1S/C20H28N4O3/c1-12(2)17(19(21)26)22-20(27)18-15-5-3-4-6-16(15)24(23-18)11-13-7-9-14(25)10-8-13/h3-6,12-14,17,25H,7-11H2,1-2H3,(H2,21,26)(H,22,27)/t13?,14?,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H28N4O3
Molecular Weight	372.4613
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 11:22:18 GMT 2025` Edited by `admin` on `Wed Apr 02 11:22:18 GMT 2025`
Record UNII	7QM8AHK8DN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(S)-N-(1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)-1-((4-HYDROXYCYCLOHEXYL)METHYL)-1H-INDAZOLE-3-CARBOXAMIDE

Systematic Name

English

AB-CHMINACA METABOLITE M1A

Preferred Name

English

Code System Code Type Description

FDA UNII

7QM8AHK8DN

Created by admin on Wed Apr 02 11:22:18 GMT 2025 , Edited by admin on Wed Apr 02 11:22:18 GMT 2025

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CAS

2130879-83-1

Created by admin on Wed Apr 02 11:22:18 GMT 2025 , Edited by admin on Wed Apr 02 11:22:18 GMT 2025

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PUBCHEM

125181279

Created by admin on Wed Apr 02 11:22:18 GMT 2025 , Edited by admin on Wed Apr 02 11:22:18 GMT 2025

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CAYMAN

16387

Created by admin on Wed Apr 02 11:22:18 GMT 2025 , Edited by admin on Wed Apr 02 11:22:18 GMT 2025

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AB-CHMINACA

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Amount: