2-ethanimidoyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[(6-methyl-1H-benzimidazol-2-yl)thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(6-methyl-1H-benzimidazol-2-yl)thio]butyronitrile Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C(C#N)C(=N)C

InChI

InChI=1S/C14H14N4OS/c1-8-3-4-11-12(5-8)18-14(17-11)20-7-13(19)10(6-15)9(2)16/h3-5,10,16H,7H2,1-2H3,(H,17,18)