N-[3-(4-methylphenyl)sulfanylpropyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide

Systemtic Name: N-[3-(4-methylphenyl)sulfanylpropyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-[3-(p-tolylsulfanyl)propyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[3-[(4-methylphenyl)thio]propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[3-(4-methylphenyl)sulfanylpropyl]acetamide Traditional Name: 2-(N-besyl-4-isopropyl-anilino)-N-[3-(p-tolylthio)propyl]acetamide Formula: C27H32N2O3S2 MolecularWeight: 496.68458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCNC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCCNC(=O)CN(C2=CC=C(C=C2)C(C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H32N2O3S2/c1-21(2)23-12-14-24(15-13-23)29(34(31,32)26-8-5-4-6-9-26)20-27(30)28-18-7-19-33-25-16-10-22(3)11-17-25/h4-6,8-17,21H,7,18-20H2,1-3H3,(H,28,30)