1-(2,4-dimethylphenyl)sulfonyl-N-[(2S)-6-methylheptan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(2S)-6-methylheptan-2-yl]piperidine-4-carboxamide Openeye Name: N-[(1S)-1,5-dimethylhexyl]-1-(2,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(2S)-6-methylheptan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(2S)-6-methylheptan-2-yl]piperidine-4-carboxamide Traditional Name: N-[(1S)-1,5-dimethylhexyl]-1-(2,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2O3S/c1-16(2)7-6-8-19(5)23-22(25)20-11-13-24(14-12-20)28(26,27)21-10-9-17(3)15-18(21)4/h9-10,15-16,19-20H,6-8,11-14H2,1-5H3,(H,23,25)/t19-/m0/s1