2-[1-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: 2-[1-(2,3-dihydro-1-benzofuran-5-ylcarbonyl)piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(2,3-dihydrobenzofuran-5-carbonyl)-4-piperidyl]-N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[2,3-dihydrobenzofuran-5-yl(oxo)methyl]-4-piperidinyl]-N-[2-(2-furanylmethylthio)ethyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(2,3-dihydro-1-benzofuran-5-carbonyl)piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(coumaran-5-carbonyl)-4-piperidyl]-N-[2-(2-furfurylthio)ethyl]-6-methyl-nicotinamide Formula: C28H31N3O4S MolecularWeight: 505.62844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C28H31N3O4S/c1-19-4-6-24(27(32)29-11-16-36-18-23-3-2-14-34-23)26(30-19)20-8-12-31(13-9-20)28(33)22-5-7-25-21(17-22)10-15-35-25/h2-7,14,17,20H,8-13,15-16,18H2,1H3,(H,29,32)