(2S)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-(4-methylphenyl)sulfanyl-propanamide Openeye Name: (2S)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-(p-tolylsulfanyl)propanamide CAS Name: (2S)-N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-2-[(4-methylphenyl)thio]propanamide IUPAC Name: (2S)-N-[3-(dimethylsulfamoyl)-4-ethoxyphenyl]-2-(4-methylphenyl)sulfanylpropanamide Traditional Name: (2S)-N-[3-(dimethylsulfamoyl)-4-ethoxy-phenyl]-2-(p-tolylthio)propionamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=C(C=C2)C)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)[C@H](C)SC2=CC=C(C=C2)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C20H26N2O4S2/c1-6-26-18-12-9-16(13-19(18)28(24,25)22(4)5)21-20(23)15(3)27-17-10-7-14(2)8-11-17/h7-13,15H,6H2,1-5H3,(H,21,23)/t15-/m0/s1