N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]propanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(3,5-dimethylphenyl)-methylsulfonyl-amino]propanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(3,5-dimethyl-N-methylsulfonyl-anilino)propanamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(3,5-dimethyl-N-methylsulfonylanilino)propanamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(3,5-dimethyl-N-methylsulfonylanilino)propanamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(N-mesyl-3,5-dimethyl-anilino)propionamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C)C(=O)NCCSC2=CC=C(C=C2)Cl)S(=O)(=O)C)C

InChI

InChI=1S/C20H25ClN2O3S2/c1-14-11-15(2)13-18(12-14)23(28(4,25)26)16(3)20(24)22-9-10-27-19-7-5-17(21)6-8-19/h5-8,11-13,16H,9-10H2,1-4H3,(H,22,24)