N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanoethyl)-N-(4-fluorophenyl)-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetamide Formula: C21H19FN4OS MolecularWeight: 394.465163

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)N(CCC#N)C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CN1C(=CN=C1SCC(=O)N(CCC#N)C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C21H19FN4OS/c1-25-19(16-6-3-2-4-7-16)14-24-21(25)28-15-20(27)26(13-5-12-23)18-10-8-17(22)9-11-18/h2-4,6-11,14H,5,13,15H2,1H3