2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(4-methylphenyl)thiophen-2-yl]ethanamide

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(4-methylphenyl)thiophen-2-yl]ethanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(p-tolyl)-2-thienyl]acetamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-[3-cyano-4-(4-methylphenyl)-2-thiophenyl]acetamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(4-methylphenyl)thiophen-2-yl]acetamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-[3-cyano-4-(p-tolyl)-2-thienyl]acetamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)CSC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)CSC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C22H19N3O2S2/c1-14-6-8-16(9-7-14)20-12-29-22(19(20)11-23)25-21(27)13-28-18-5-3-4-17(10-18)24-15(2)26/h3-10,12H,13H2,1-2H3,(H,24,26)(H,25,27)