N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-[(4-methylphenyl)-methylsulfonyl-amino]butanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-methyl-N-methylsulfonyl-anilino)butanamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-methyl-N-methylsulfonylanilino)butanamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(N-mesyl-4-methyl-anilino)butyramide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCSC1=CC=C(C=C1)Cl)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCSC1=CC=C(C=C1)Cl)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

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