N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethylsulfonylpiperidin-4-yl)-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethylsulfonylpiperidin-4-yl)-6-methyl-pyridine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethylsulfonyl-4-piperidyl)-6-methyl-pyridine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethylsulfonyl-4-piperidinyl)-6-methyl-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-ethylsulfonylpiperidin-4-yl)-6-methylpyridine-3-carboxamide Traditional Name: 2-(1-esyl-4-piperidyl)-6-methyl-N-piperonyl-nicotinamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C2=C(C=CC(=N2)C)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H27N3O5S/c1-3-31(27,28)25-10-8-17(9-11-25)21-18(6-4-15(2)24-21)22(26)23-13-16-5-7-19-20(12-16)30-14-29-19/h4-7,12,17H,3,8-11,13-14H2,1-2H3,(H,23,26)