1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(4-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-N-(pyridin-4-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methoxy-5-methylphenyl)sulfonyl-N-(pyridin-4-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-methoxy-5-methyl-phenyl)sulfonyl-N-(4-pyridylmethyl)isonipecotamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-15-3-4-18(27-2)19(13-15)28(25,26)23-11-7-17(8-12-23)20(24)22-14-16-5-9-21-10-6-16/h3-6,9-10,13,17H,7-8,11-12,14H2,1-2H3,(H,22,24)