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

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[1-(2-methylpropylamino)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]piperidine-4-carboxamide Openeye Name: N-[1-(isobutylcarbamoyl)-3-methylsulfanyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[1-(2-methylpropylamino)-4-(methylthio)-1-oxobutan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[1-(2-methylpropylamino)-4-methylsulfanyl-1-oxobutan-2-yl]piperidine-4-carboxamide Traditional Name: N-[1-(isobutylcarbamoyl)-3-(methylthio)propyl]-1-tosyl-isonipecotamide Formula: C22H35N3O4S2 MolecularWeight: 469.661

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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)NCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O4S2/c1-16(2)15-23-22(27)20(11-14-30-4)24-21(26)18-9-12-25(13-10-18)31(28,29)19-7-5-17(3)6-8-19/h5-8,16,18,20H,9-15H2,1-4H3,(H,23,27)(H,24,26)