N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(S)-cyclopropyl(phenyl)methyl]-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C24H30N2O3S MolecularWeight: 426.5716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C3CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N[C@@H](C3CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C24H30N2O3S/c1-17-8-11-22(16-18(17)2)30(28,29)26-14-12-21(13-15-26)24(27)25-23(20-9-10-20)19-6-4-3-5-7-19/h3-8,11,16,20-21,23H,9-10,12-15H2,1-2H3,(H,25,27)/t23-/m1/s1