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

Systemtic Name: N-[(2S)-6-methylheptan-2-yl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(1S)-1,5-dimethylhexyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(2S)-6-methylheptan-2-yl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-6-methylheptan-2-yl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(1S)-1,5-dimethylhexyl]-1-mesitylsulfonyl-isonipecotamide Formula: C23H38N2O3S MolecularWeight: 422.62442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H38N2O3S/c1-16(2)8-7-9-20(6)24-23(26)21-10-12-25(13-11-21)29(27,28)22-18(4)14-17(3)15-19(22)5/h14-16,20-21H,7-13H2,1-6H3,(H,24,26)/t20-/m0/s1