(2E)-4-(2,5-dimethylphenyl)sulfanyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-4-(2,5-dimethylphenyl)sulfanyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: (2E)-4-(2,5-dimethylphenyl)sulfanyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-butanenitrile CAS Name: (2E)-4-[(2,5-dimethylphenyl)thio]-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: (2E)-4-(2,5-dimethylphenyl)sulfanyl-2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxobutanenitrile Traditional Name: (2E)-4-[(2,5-dimethylphenyl)thio]-3-keto-2-(3-methyl-1H-benzimidazol-2-ylidene)butyronitrile Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)C(=C2NC3=CC=CC=C3N2C)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)/C(=C/2\NC3=CC=CC=C3N2C)/C#N

InChI

InChI=1S/C20H19N3OS/c1-13-8-9-14(2)19(10-13)25-12-18(24)15(11-21)20-22-16-6-4-5-7-17(16)23(20)3/h4-10,22H,12H2,1-3H3/b20-15+