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

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(3-thiophen-2-ylprop-2-enoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-2-[1-[3-(2-thienyl)prop-2-enoyl]-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-6-methyl-2-[1-(1-oxo-3-thiophen-2-ylprop-2-enyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(3-thiophen-2-ylprop-2-enoyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-6-methyl-2-[1-[3-(2-thienyl)acryloyl]-4-piperidyl]nicotinamide Formula: C26H29N3O3S2 MolecularWeight: 495.65676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C=CC4=CC=CS4

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCSCC2=CC=CO2)C3CCN(CC3)C(=O)C=CC4=CC=CS4

InChI

InChI=1S/C26H29N3O3S2/c1-19-6-8-23(26(31)27-12-17-33-18-21-4-2-15-32-21)25(28-19)20-10-13-29(14-11-20)24(30)9-7-22-5-3-16-34-22/h2-9,15-16,20H,10-14,17-18H2,1H3,(H,27,31)