(2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: (2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: (2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: (2Z)-4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-keto-2-(3-methyl-1H-benzimidazol-2-ylidene)butyronitrile Formula: C18H18N6OS MolecularWeight: 366.44012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CC2)SCC(=O)C(=C3NC4=CC=CC=C4N3C)C#N

Isomeric SMILES

CC1=NN=C(N1C2CC2)SCC(=O)/C(=C\3/NC4=CC=CC=C4N3C)/C#N

InChI

InChI=1S/C18H18N6OS/c1-11-21-22-18(24(11)12-7-8-12)26-10-16(25)13(9-19)17-20-14-5-3-4-6-15(14)23(17)2/h3-6,12,20H,7-8,10H2,1-2H3/b17-13-