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

Systemtic Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(4-methylphenyl)thiophen-2-yl]propanamide Openeye Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(p-tolyl)-2-thienyl]propanamide CAS Name: 2-[(3-acetamidophenyl)thio]-N-[3-cyano-4-(4-methylphenyl)-2-thiophenyl]propanamide IUPAC Name: 2-(3-acetamidophenyl)sulfanyl-N-[3-cyano-4-(4-methylphenyl)thiophen-2-yl]propanamide Traditional Name: 2-[(3-acetamidophenyl)thio]-N-[3-cyano-4-(p-tolyl)-2-thienyl]propionamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C(C)SC3=CC=CC(=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C(C)SC3=CC=CC(=C3)NC(=O)C

InChI

InChI=1S/C23H21N3O2S2/c1-14-7-9-17(10-8-14)21-13-29-23(20(21)12-24)26-22(28)15(2)30-19-6-4-5-18(11-19)25-16(3)27/h4-11,13,15H,1-3H3,(H,25,27)(H,26,28)