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

Systemtic Name: 2-[1-[(2-ethyl-6-methyl-phenyl)carbamothioyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-4-piperidyl]-N-[2-(2-furylmethylsulfanyl)ethyl]-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-4-piperidinyl]-N-[2-(2-furanylmethylthio)ethyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-[(2-ethyl-6-methylphenyl)carbamothioyl]piperidin-4-yl]-N-[2-(furan-2-ylmethylsulfanyl)ethyl]-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]-4-piperidyl]-N-[2-(2-furfurylthio)ethyl]-6-methyl-nicotinamide Formula: C29H36N4O2S2 MolecularWeight: 536.75174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NCCSCC4=CC=CO4)C

InChI

InChI=1S/C29H36N4O2S2/c1-4-22-8-5-7-20(2)26(22)32-29(36)33-15-12-23(13-16-33)27-25(11-10-21(3)31-27)28(34)30-14-18-37-19-24-9-6-17-35-24/h5-11,17,23H,4,12-16,18-19H2,1-3H3,(H,30,34)(H,32,36)