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

Systemtic Name: ethyl 1-[6-(4-methylthiophen-2-yl)-3-[(1-oxidanylcyclohexyl)methylcarbamoyl]pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(1-hydroxycyclohexyl)methylcarbamoyl]-6-(4-methyl-2-thienyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-[[(1-hydroxycyclohexyl)methylamino]-oxomethyl]-6-(4-methyl-2-thiophenyl)-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[(1-hydroxycyclohexyl)methylcarbamoyl]-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-[(1-hydroxycyclohexyl)methylcarbamoyl]-6-(4-methyl-2-thienyl)-2-pyridyl]isonipecotic acid ethyl ester Formula: C26H35N3O4S MolecularWeight: 485.6388

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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)NCC4(CCCCC4)O

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)C3=CC(=CS3)C)C(=O)NCC4(CCCCC4)O

InChI

InChI=1S/C26H35N3O4S/c1-3-33-25(31)19-9-13-29(14-10-19)23-20(7-8-21(28-23)22-15-18(2)16-34-22)24(30)27-17-26(32)11-5-4-6-12-26/h7-8,15-16,19,32H,3-6,9-14,17H2,1-2H3,(H,27,30)