N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-2-[(3-methylphenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-2-[(3-methylphenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-2-(3-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]propyl]-2-(3-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-2-(3-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]propyl]-2-(N-mesyl-3-methyl-anilino)acetamide Formula: C20H25ClN2O3S2 MolecularWeight: 441.0071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC(=O)NCCCSCC2=CC=C(C=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC(=O)NCCCSCC2=CC=C(C=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H25ClN2O3S2/c1-16-5-3-6-19(13-16)23(28(2,25)26)14-20(24)22-11-4-12-27-15-17-7-9-18(21)10-8-17/h3,5-10,13H,4,11-12,14-15H2,1-2H3,(H,22,24)