2-[[5-[2-(indol-3-ylidenemethyl)hydrazinyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile

Systemtic Name: 2-[[5-[2-(indol-3-ylidenemethyl)hydrazinyl]-1H-1,2,4-triazol-3-yl]sulfanyl]ethanenitrile Openeye Name: 2-[[5-[2-(indol-3-ylidenemethyl)hydrazino]-1H-1,2,4-triazol-3-yl]sulfanyl]acetonitrile CAS Name: 2-[[5-(3-indolylidenemethylhydrazo)-1H-1,2,4-triazol-3-yl]thio]acetonitrile IUPAC Name: 2-[[5-[2-(indol-3-ylidenemethyl)hydrazinyl]-1H-1,2,4-triazol-3-yl]sulfanyl]acetonitrile Traditional Name: 2-[[5-[N'-(indol-3-ylidenemethyl)hydrazino]-1H-1,2,4-triazol-3-yl]thio]acetonitrile Formula: C13H11N7S MolecularWeight: 297.33834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNNC3=NC(=NN3)SCC#N)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNNC3=NC(=NN3)SCC#N)C=N2

InChI

InChI=1S/C13H11N7S/c14-5-6-21-13-17-12(19-20-13)18-16-8-9-7-15-11-4-2-1-3-10(9)11/h1-4,7-8,16H,6H2,(H2,17,18,19,20)