N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-2-(methylthio)nicotinamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C20H25N3O4S2/c1-3-27-18-10-9-15(29(25,26)23-12-5-4-6-13-23)14-17(18)22-19(24)16-8-7-11-21-20(16)28-2/h7-11,14H,3-6,12-13H2,1-2H3,(H,22,24)