TETCYCLACIS

Details

Stereochemistry	RACEMIC
Molecular Formula	C13H12ClN5
Molecular Weight	273.721
Optical Activity	( + / - )
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12N=N[C@]1([H])[C@@H]3C[C@H]2[C@@]4([H])N=NN(C5=CC=C(Cl)C=C5)[C@@]34[H]

InChI

InChIKey=DPOWHSMECVNHAT-YERPJTIDSA-N

InChI=1S/C13H12ClN5/c14-6-1-3-7(4-2-6)19-13-9-5-8(12(13)17-18-19)10-11(9)16-15-10/h1-4,8-13H,5H2/t8-,9+,10+,11-,12-,13+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C13H12ClN5
Molecular Weight	273.721
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:21:48 GMT 2023` Edited by `admin` on `Sat Dec 16 09:21:48 GMT 2023`
Record UNII	3X7E1WJ6HO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TETCYCLACIS

Common Name

English

KENBYO

Brand Name

English

TETRACYCLACIS

Common Name

English

LAB-102883

Code

English

4,7-METHANO-1H-(1,2)DIAZETO(3,4-F)BENZOTRIAZOLE, 1-(4-CHLOROPHENYL)-3A,4,4A,6A,7,7A-HEXAHYDRO-, (3A.ALPHA.,4.BETA.,4A.ALPHA.,6A.ALPHA.,7.BETA.,7A.ALPHA.)-

Systematic Name

English

TETCYCLACIS [ISO]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID801024174