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

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(2-thiophen-3-ylsulfanylethanoyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-[2-(3-thienylsulfanyl)acetyl]-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-[1-oxo-2-(3-thiophenylthio)ethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(2-thiophen-3-ylsulfanylacetyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(2-ethoxybenzyl)-6-methyl-2-[1-[2-(3-thienylthio)acetyl]-4-piperidyl]nicotinamide Formula: C27H31N3O3S2 MolecularWeight: 509.68334

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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(=O)CSC4=CSC=C4

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)CSC4=CSC=C4

InChI

InChI=1S/C27H31N3O3S2/c1-3-33-24-7-5-4-6-21(24)16-28-27(32)23-9-8-19(2)29-26(23)20-10-13-30(14-11-20)25(31)18-35-22-12-15-34-17-22/h4-9,12,15,17,20H,3,10-11,13-14,16,18H2,1-2H3,(H,28,32)