N-(cyanomethyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-N-phenyl-2-[4-(p-tolyl)thiazol-2-yl]sulfanyl-acetamide CAS Name: N-(cyanomethyl)-2-[[4-(4-methylphenyl)-2-thiazolyl]thio]-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: N-(cyanomethyl)-N-phenyl-2-[[4-(p-tolyl)thiazol-2-yl]thio]acetamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)N(CC#N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)N(CC#N)C3=CC=CC=C3

InChI

InChI=1S/C20H17N3OS2/c1-15-7-9-16(10-8-15)18-13-25-20(22-18)26-14-19(24)23(12-11-21)17-5-3-2-4-6-17/h2-10,13H,12,14H2,1H3