2-ethanimidoyl-4-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-ethanimidoyl-4-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-ethanimidoyl-4-[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1-iminoethyl)-4-[[1-(2-methoxyphenyl)-5-phenyl-2-imidazolyl]thio]-3-oxobutanenitrile IUPAC Name: 2-ethanimidoyl-4-[1-(2-methoxyphenyl)-5-phenylimidazol-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-3-keto-4-[[1-(2-methoxyphenyl)-5-phenyl-imidazol-2-yl]thio]butyronitrile Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC=C(N1C2=CC=CC=C2OC)C3=CC=CC=C3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC=C(N1C2=CC=CC=C2OC)C3=CC=CC=C3

InChI

InChI=1S/C22H20N4O2S/c1-15(24)17(12-23)20(27)14-29-22-25-13-19(16-8-4-3-5-9-16)26(22)18-10-6-7-11-21(18)28-2/h3-11,13,17,24H,14H2,1-2H3