N-[(2S)-2-(dimethylamino)-2-phenyl-ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2S)-2-(dimethylamino)-2-phenyl-ethyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2S)-2-(dimethylamino)-2-phenyl-ethyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(2S)-2-(dimethylamino)-2-phenylethyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2S)-2-(dimethylamino)-2-phenylethyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(2S)-2-(dimethylamino)-2-phenyl-ethyl]-1-tosyl-isonipecotamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC(C3=CC=CC=C3)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC[C@H](C3=CC=CC=C3)N(C)C

InChI

InChI=1S/C23H31N3O3S/c1-18-9-11-21(12-10-18)30(28,29)26-15-13-20(14-16-26)23(27)24-17-22(25(2)3)19-7-5-4-6-8-19/h4-12,20,22H,13-17H2,1-3H3,(H,24,27)/t22-/m1/s1