1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxypyridin-3-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxypyridin-3-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxy-3-pyridyl)methyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxy-3-pyridinyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxypyridin-3-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-[(2-methoxy-3-pyridyl)methyl]isonipecotamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(N=CC=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(N=CC=C3)OC)C

InChI

InChI=1S/C21H27N3O4S/c1-15-6-7-19(13-16(15)2)29(26,27)24-11-8-17(9-12-24)20(25)23-14-18-5-4-10-22-21(18)28-3/h4-7,10,13,17H,8-9,11-12,14H2,1-3H3,(H,23,25)