2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-(3,5-dimethyl-N-methylsulfonyl-anilino)-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-(3,5-dimethyl-N-methylsulfonylanilino)-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-(N-mesyl-3,5-dimethyl-anilino)-N-[2-(phenylthio)phenyl]propionamide Formula: C24H26N2O3S2 MolecularWeight: 454.60484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NC2=CC=CC=C2SC3=CC=CC=C3)S(=O)(=O)C)C

InChI

InChI=1S/C24H26N2O3S2/c1-17-14-18(2)16-20(15-17)26(31(4,28)29)19(3)24(27)25-22-12-8-9-13-23(22)30-21-10-6-5-7-11-21/h5-16,19H,1-4H3,(H,25,27)