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

Systemtic Name: (2R)-2-ethanimidoyl-4-[5-(4-methylphenyl)-1-phenyl-imidazol-2-yl]sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2R)-2-ethanimidoyl-3-oxo-4-[1-phenyl-5-(p-tolyl)imidazol-2-yl]sulfanyl-butanenitrile CAS Name: (2R)-2-(1-iminoethyl)-4-[[5-(4-methylphenyl)-1-phenyl-2-imidazolyl]thio]-3-oxobutanenitrile IUPAC Name: (2R)-2-ethanimidoyl-4-[5-(4-methylphenyl)-1-phenylimidazol-2-yl]sulfanyl-3-oxobutanenitrile Traditional Name: (2R)-2-acetimidoyl-3-keto-4-[[1-phenyl-5-(p-tolyl)imidazol-2-yl]thio]butyronitrile Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN=C(N2C3=CC=CC=C3)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN=C(N2C3=CC=CC=C3)SCC(=O)[C@@H](C#N)C(=N)C

InChI

InChI=1S/C22H20N4OS/c1-15-8-10-17(11-9-15)20-13-25-22(26(20)18-6-4-3-5-7-18)28-14-21(27)19(12-23)16(2)24/h3-11,13,19,24H,14H2,1-2H3/t19-/m0/s1