2-[1-[(4-acetamidophenyl)methyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: 2-[1-[(4-acetamidophenyl)methyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-[(4-acetamidophenyl)methyl]-4-piperidyl]-N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[(4-acetamidophenyl)methyl]-4-piperidinyl]-N-[2-(2-furanylmethylthio)ethyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-[(4-acetamidophenyl)methyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(4-acetamidobenzyl)-4-piperidyl]-N-[2-(2-furfurylthio)ethyl]-6-methyl-nicotinamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)CC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)CC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C28H34N4O3S/c1-20-5-10-26(28(34)29-13-17-36-19-25-4-3-16-35-25)27(30-20)23-11-14-32(15-12-23)18-22-6-8-24(9-7-22)31-21(2)33/h3-10,16,23H,11-15,17-19H2,1-2H3,(H,29,34)(H,31,33)