2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]butanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(4-isopropyl-1,2,4-triazol-3-yl)thio]-3-keto-butyronitrile Formula: C16H16N6OS MolecularWeight: 340.40284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C16H16N6OS/c1-10(2)22-9-18-21-16(22)24-8-14(23)11(7-17)15-19-12-5-3-4-6-13(12)20-15/h3-6,9-10,19-20H,8H2,1-2H3