2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methylbenzimidazol-2-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methylbenzimidazol-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methylbenzimidazol-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dimethyl-2-benzimidazolylidene)-4-[(1-methyl-2-benzimidazolyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(1-methylbenzimidazol-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dimethylbenzimidazol-2-ylidene)-3-keto-4-[(1-methylbenzimidazol-2-yl)thio]butyronitrile Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC4=CC=CC=C4N3C)C

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=C(C#N)C(=O)CSC3=NC4=CC=CC=C4N3C)C

InChI

InChI=1S/C21H19N5OS/c1-24-17-10-6-7-11-18(17)25(2)20(24)14(12-22)19(27)13-28-21-23-15-8-4-5-9-16(15)26(21)3/h4-11H,13H2,1-3H3