N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methyl-5-nitro-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methyl-5-nitro-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methyl-5-nitro-benzoyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-6-methyl-2-[1-[(2-methyl-5-nitrophenyl)-oxomethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-2-[1-(2-methyl-5-nitrobenzoyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-6-methyl-2-[1-(2-methyl-5-nitro-benzoyl)-4-piperidyl]nicotinamide Formula: C27H30N4O5S MolecularWeight: 522.6159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4

InChI

InChI=1S/C27H30N4O5S/c1-18-5-7-21(31(34)35)16-24(18)27(33)30-12-9-20(10-13-30)25-23(8-6-19(2)29-25)26(32)28-11-15-37-17-22-4-3-14-36-22/h3-8,14,16,20H,9-13,15,17H2,1-2H3,(H,28,32)