N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-(2-furylmethyl)-N,6-dimethyl-2-[1-(2-morpholinoethylcarbamothioyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-(2-furanylmethyl)-N,6-dimethyl-2-[1-[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-N,6-dimethyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(2-furfuryl)-N,6-dimethyl-2-[1-(2-morpholinoethylthiocarbamoyl)-4-piperidyl]nicotinamide Formula: C25H35N5O3S MolecularWeight: 485.6421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N(C)CC2=CC=CO2)C3CCN(CC3)C(=S)NCCN4CCOCC4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N(C)CC2=CC=CO2)C3CCN(CC3)C(=S)NCCN4CCOCC4

InChI

InChI=1S/C25H35N5O3S/c1-19-5-6-22(24(31)28(2)18-21-4-3-15-33-21)23(27-19)20-7-10-30(11-8-20)25(34)26-9-12-29-13-16-32-17-14-29/h3-6,15,20H,7-14,16-18H2,1-2H3,(H,26,34)