2-ethanimidoyl-3-oxidanylidene-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]butanenitrile

Systemtic Name: 2-ethanimidoyl-3-oxidanylidene-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]butanenitrile Openeye Name: 2-ethanimidoyl-3-oxo-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]butanenitrile CAS Name: 2-(1-iminoethyl)-3-oxo-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]butanenitrile IUPAC Name: 2-ethanimidoyl-3-oxo-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]butanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]butyronitrile Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC2=C(N1C3=CC=CC=C3)CCCC2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC2=C(N1C3=CC=CC=C3)CCCC2

InChI

InChI=1S/C19H20N4OS/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/h2-4,7-8,15,21H,5-6,9-10,12H2,1H3