ethyl 1-[3-[2-(1-methylpyrrolidin-2-yl)ethylcarbamoyl]-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[2-(1-methylpyrrolidin-2-yl)ethylcarbamoyl]-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[2-(1-methylpyrrolidin-2-yl)ethylcarbamoyl]-6-(4-methyl-2-thienyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-[[2-(1-methyl-2-pyrrolidinyl)ethylamino]-oxomethyl]-6-(4-methyl-2-thiophenyl)-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[2-(1-methylpyrrolidin-2-yl)ethylcarbamoyl]-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[2-(1-methylpyrrolidin-2-yl)ethylcarbamoyl]-6-(4-methyl-2-thienyl)-2-pyridyl]isonipecotic acid ethyl ester Formula: C26H36N4O3S MolecularWeight: 484.65404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)C3=CC(=CS3)C)C(=O)NCCC4CCCN4C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)C3=CC(=CS3)C)C(=O)NCCC4CCCN4C

InChI

InChI=1S/C26H36N4O3S/c1-4-33-26(32)19-10-14-30(15-11-19)24-21(7-8-22(28-24)23-16-18(2)17-34-23)25(31)27-12-9-20-6-5-13-29(20)3/h7-8,16-17,19-20H,4-6,9-15H2,1-3H3,(H,27,31)