1-(4-methylphenyl)sulfonyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[4-methylsulfanyl-1-oxidanylidene-1-[(phenylmethyl)amino]butan-2-yl]piperidine-4-carboxamide Openeye Name: N-[1-(benzylcarbamoyl)-3-methylsulfanyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[4-(methylthio)-1-oxo-1-[(phenylmethyl)amino]butan-2-yl]-4-piperidinecarboxamide IUPAC Name: N-[1-(benzylamino)-4-methylsulfanyl-1-oxobutan-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(benzylcarbamoyl)-3-(methylthio)propyl]-1-tosyl-isonipecotamide Formula: C25H33N3O4S2 MolecularWeight: 503.67722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(CCSC)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(CCSC)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4S2/c1-19-8-10-22(11-9-19)34(31,32)28-15-12-21(13-16-28)24(29)27-23(14-17-33-2)25(30)26-18-20-6-4-3-5-7-20/h3-11,21,23H,12-18H2,1-2H3,(H,26,30)(H,27,29)