N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(5-methylsulfanylthiophen-2-yl)carbonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(5-methylsulfanylthiophen-2-yl)carbonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(5-methylsulfanylthiophene-2-carbonyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-[[5-(methylthio)-2-thiophenyl]-oxomethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[(2-ethoxyphenyl)methyl]-6-methyl-2-[1-(5-methylsulfanylthiophene-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(2-ethoxybenzyl)-6-methyl-2-[1-[5-(methylthio)thiophene-2-carbonyl]-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)C4=CC=C(S4)SC

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=CC=C(S4)SC

InChI

InChI=1S/C27H31N3O3S2/c1-4-33-22-8-6-5-7-20(22)17-28-26(31)21-10-9-18(2)29-25(21)19-13-15-30(16-14-19)27(32)23-11-12-24(34-3)35-23/h5-12,19H,4,13-17H2,1-3H3,(H,28,31)