4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[(2R)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]cyclohexane-1-carboxamide Openeye Name: N-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]-4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxamide CAS Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[(2R)-1-oxo-1-(1-piperidinyl)propan-2-yl]-1-cyclohexanecarboxamide IUPAC Name: 4-[[(4-methylphenyl)sulfonylamino]methyl]-N-[(2R)-1-oxo-1-piperidin-1-ylpropan-2-yl]cyclohexane-1-carboxamide Traditional Name: N-[(1R)-2-keto-1-methyl-2-piperidino-ethyl]-4-[(tosylamino)methyl]cyclohexanecarboxamide Formula: C23H35N3O4S MolecularWeight: 449.6067

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NC(C)C(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)N[C@H](C)C(=O)N3CCCCC3

InChI

InChI=1S/C23H35N3O4S/c1-17-6-12-21(13-7-17)31(29,30)24-16-19-8-10-20(11-9-19)22(27)25-18(2)23(28)26-14-4-3-5-15-26/h6-7,12-13,18-20,24H,3-5,8-11,14-16H2,1-2H3,(H,25,27)/t18-,19?,20?/m1/s1