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

Systemtic Name: N-[3-[(4-methylphenyl)methylsulfanyl]propyl]-2-[phenylsulfonyl-(4-propan-2-ylphenyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-isopropyl-anilino]-N-[3-(p-tolylmethylsulfanyl)propyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[3-[(4-methylphenyl)methylthio]propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-propan-2-ylanilino]-N-[3-[(4-methylphenyl)methylsulfanyl]propyl]acetamide Traditional Name: 2-(N-besyl-4-isopropyl-anilino)-N-[3-[(4-methylbenzyl)thio]propyl]acetamide Formula: C28H34N2O3S2 MolecularWeight: 510.71116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N2O3S2/c1-22(2)25-14-16-26(17-15-25)30(35(32,33)27-8-5-4-6-9-27)20-28(31)29-18-7-19-34-21-24-12-10-23(3)11-13-24/h4-6,8-17,22H,7,18-21H2,1-3H3,(H,29,31)