ADB-FUBINACA

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H23FN4O2
Molecular Weight	382.4313
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ADB-FUBINACA

Structure Search

SMILES

CC(C)(C)[C@H](NC(=O)C1=NN(CC2=CC=C(F)C=C2)C3=CC=CC=C13)C(N)=O

InChI

InChIKey=ZSSGCSINPVBLQD-GOSISDBHSA-N

InChI=1S/C21H23FN4O2/c1-21(2,3)18(19(23)27)24-20(28)17-15-6-4-5-7-16(15)26(25-17)12-13-8-10-14(22)11-9-13/h4-11,18H,12H2,1-3H3,(H2,23,27)(H,24,28)/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H23FN4O2
Molecular Weight	382.4313
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 10:40:23 UTC 2023` Edited by `admin` on `Sat Dec 16 10:40:23 UTC 2023`
Record UNII	05235E1S2O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ADB-FUBINACA

Common Name

English

1H-INDAZOLE-3-CARBOXAMIDE, N-((1S)-1-(AMINOCARBONYL)-2,2-DIMETHYLPROPYL)-1-((4-FLUOROPHENYL)METHYL)-

Systematic Name

English

N-(1-(AMINOCARBONYL)-2,2-DIMETHYLPROPYL)-1-((4-FLUOROPHENYL)METHYL)-1H-INDAZOLE-3-CARBOXAMIDE, (S)-

Systematic Name

English

N-(1-AMINO-3,3-DIMETHYL-1-OXOBUTAN-2-YL)-1-(4-FLUOROBENZYL)-1H-INDAZOLE-3-CARBOXAMIDE, (S)-

Common Name

English

J3.293.458G

Code

English

Classification Tree Code System Code

WIKIPEDIA

Designer-drugs-ADB-FUBINACA

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

DEA NO.

7010

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

Code System Code Type Description

PUBCHEM

58124399

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

FDA UNII

05235E1S2O

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

WIKIPEDIA

ADB-FUBINACA

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

EPA CompTox

DTXSID70100998

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

CAS

1445583-51-6

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

NON-SPECIFIC STEREOCHEMISTRY

SMS_ID

100000183998

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

CAS

1185282-00-1

Created by admin on Sat Dec 16 10:40:23 UTC 2023 , Edited by admin on Sat Dec 16 10:40:23 UTC 2023

PRIMARY

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ACTIVE MOIETY