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

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(pentylamino)butan-2-yl]piperidine-4-carboxamide Openeye Name: N-[3-methylsulfanyl-1-(pentylcarbamoyl)propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[4-(methylthio)-1-oxo-1-(pentylamino)butan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[4-methylsulfanyl-1-oxo-1-(pentylamino)butan-2-yl]piperidine-4-carboxamide Traditional Name: N-[1-(amylcarbamoyl)-3-(methylthio)propyl]-1-tosyl-isonipecotamide Formula: C23H37N3O4S2 MolecularWeight: 483.68758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(CCSC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCNC(=O)C(CCSC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C23H37N3O4S2/c1-4-5-6-14-24-23(28)21(13-17-31-3)25-22(27)19-11-15-26(16-12-19)32(29,30)20-9-7-18(2)8-10-20/h7-10,19,21H,4-6,11-17H2,1-3H3,(H,24,28)(H,25,27)