2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 4-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxobutanenitrile Traditional Name: 4-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-butyronitrile Formula: C17H16N6OS MolecularWeight: 352.41354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C17H16N6OS/c1-3-8-23-11(2)21-22-17(23)25-10-15(24)12(9-18)16-19-13-6-4-5-7-14(13)20-16/h3-7,19-20H,1,8,10H2,2H3