N-(cyanomethyl)-N-phenyl-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(cyanomethyl)-N-phenyl-2-(2,4,6-trimethylphenyl)sulfanyl-ethanamide Openeye Name: N-(cyanomethyl)-N-phenyl-2-(2,4,6-trimethylphenyl)sulfanyl-acetamide CAS Name: N-(cyanomethyl)-N-phenyl-2-[(2,4,6-trimethylphenyl)thio]acetamide IUPAC Name: N-(cyanomethyl)-N-phenyl-2-(2,4,6-trimethylphenyl)sulfanylacetamide Traditional Name: N-(cyanomethyl)-2-(mesitylthio)-N-phenyl-acetamide Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2OS/c1-14-11-15(2)19(16(3)12-14)23-13-18(22)21(10-9-20)17-7-5-4-6-8-17/h4-8,11-12H,10,13H2,1-3H3