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

Systemtic Name: ethyl 1-[3-(cyclopropylcarbamoyl)-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(cyclopropylcarbamoyl)-6-(4-methyl-2-thienyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-[(cyclopropylamino)-oxomethyl]-6-(4-methyl-2-thiophenyl)-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(cyclopropylcarbamoyl)-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(cyclopropylcarbamoyl)-6-(4-methyl-2-thienyl)-2-pyridyl]isonipecotic acid ethyl ester Formula: C22H27N3O3S MolecularWeight: 413.53308

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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)NC4CC4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)C3=CC(=CS3)C)C(=O)NC4CC4

InChI

InChI=1S/C22H27N3O3S/c1-3-28-22(27)15-8-10-25(11-9-15)20-17(21(26)23-16-4-5-16)6-7-18(24-20)19-12-14(2)13-29-19/h6-7,12-13,15-16H,3-5,8-11H2,1-2H3,(H,23,26)