2-ethanimidoyl-3-oxidanylidene-4-(1-phenylbenzimidazol-2-yl)sulfanyl-butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-(1-phenylbenzimidazol-2-yl)sulfanyl-butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-(1-phenylbenzimidazol-2-yl)sulfanyl-butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(1-phenyl-2-benzimidazolyl)thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-(1-phenylbenzimidazol-2-yl)sulfanylbutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(1-phenylbenzimidazol-2-yl)thio]butyronitrile Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2N1C3=CC=CC=C3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=CC=CC=C2N1C3=CC=CC=C3

InChI

InChI=1S/C19H16N4OS/c1-13(21)15(11-20)18(24)12-25-19-22-16-9-5-6-10-17(16)23(19)14-7-3-2-4-8-14/h2-10,15,21H,12H2,1H3