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

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-2-(isobutylamino)-2-keto-1-methyl-ethyl]-1-tosyl-isonipecotamide Formula: C20H31N3O4S MolecularWeight: 409.54284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@@H](C)C(=O)NCC(C)C

InChI

InChI=1S/C20H31N3O4S/c1-14(2)13-21-19(24)16(4)22-20(25)17-9-11-23(12-10-17)28(26,27)18-7-5-15(3)6-8-18/h5-8,14,16-17H,9-13H2,1-4H3,(H,21,24)(H,22,25)/t16-/m0/s1