N-(2-methyl-5-methylsulfonyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-1-(3-pyridylsulfonyl)isonipecotamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H23N3O5S2/c1-14-5-6-16(28(2,24)25)12-18(14)21-19(23)15-7-10-22(11-8-15)29(26,27)17-4-3-9-20-13-17/h3-6,9,12-13,15H,7-8,10-11H2,1-2H3,(H,21,23)