4-(1,5-diphenylimidazol-2-yl)sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(1,5-diphenylimidazol-2-yl)sulfanyl-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-(1,5-diphenylimidazol-2-yl)sulfanyl-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[(1,5-diphenyl-2-imidazolyl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-(1,5-diphenylimidazol-2-yl)sulfanyl-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[(1,5-diphenylimidazol-2-yl)thio]-3-keto-butyronitrile Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NC=C(N1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NC=C(N1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H18N4OS/c1-15(23)18(12-22)20(26)14-27-21-24-13-19(16-8-4-2-5-9-16)25(21)17-10-6-3-7-11-17/h2-11,13,18,23H,14H2,1H3