N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-2-(methylthio)nicotinamide Formula: C19H23N3O4S2 MolecularWeight: 421.53362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=C(N=CC=C2)SC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H23N3O4S2/c1-26-16-9-8-14(21-18(23)15-7-6-10-20-19(15)27-2)13-17(16)28(24,25)22-11-4-3-5-12-22/h6-10,13H,3-5,11-12H2,1-2H3,(H,21,23)