N-[(2-ethoxyphenyl)methyl]-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-2-[1-[(4-methoxyphenyl)carbamothioyl]-4-piperidyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[(2-ethoxyphenyl)methyl]-2-[1-[(4-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methylpyridine-3-carboxamide Traditional Name: N-(2-ethoxybenzyl)-2-[1-[(4-methoxyphenyl)thiocarbamoyl]-4-piperidyl]-6-methyl-nicotinamide Formula: C29H34N4O3S MolecularWeight: 518.67026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C29H34N4O3S/c1-4-36-26-8-6-5-7-22(26)19-30-28(34)25-14-9-20(2)31-27(25)21-15-17-33(18-16-21)29(37)32-23-10-12-24(35-3)13-11-23/h5-14,21H,4,15-19H2,1-3H3,(H,30,34)(H,32,37)