N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[3-[(3-methylphenyl)methylsulfanyl]propyl]-2-[phenyl(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)anilino]-N-[3-(m-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)anilino]-N-[3-[(3-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)anilino]-N-[3-[(3-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(N-besylanilino)-N-[3-[(3-methylbenzyl)thio]propyl]acetamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)CSCCCNC(=O)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O3S2/c1-21-10-8-11-22(18-21)20-31-17-9-16-26-25(28)19-27(23-12-4-2-5-13-23)32(29,30)24-14-6-3-7-15-24/h2-8,10-15,18H,9,16-17,19-20H2,1H3,(H,26,28)