2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(1H-1,2,4-triazol-5-ylthio)butanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(1H-1,2,4-triazol-5-ylsulfanyl)butanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-(1H-1,2,4-triazol-5-ylthio)butyronitrile Formula: C13H10N6OS MolecularWeight: 298.3231

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC=NN3)N2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC=NN3)N2

InChI

InChI=1S/C13H10N6OS/c14-5-8(11(20)6-21-13-15-7-16-19-13)12-17-9-3-1-2-4-10(9)18-12/h1-4,7,17-18H,6H2,(H,15,16,19)