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

Systemtic Name: ethyl 1-[3-(2-diethylaminoethylcarbamoyl)-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(2-diethylaminoethylcarbamoyl)-6-(4-methyl-2-thienyl)-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[3-[(2-diethylaminoethylamino)-oxomethyl]-6-(4-methyl-2-thiophenyl)-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(2-diethylaminoethylcarbamoyl)-6-(4-methylthiophen-2-yl)pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[3-(2-diethylaminoethylcarbamoyl)-6-(4-methyl-2-thienyl)-2-pyridyl]isonipecotic acid ethyl ester Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(N=C(C=C1)C2=CC(=CS2)C)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(N=C(C=C1)C2=CC(=CS2)C)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C25H36N4O3S/c1-5-28(6-2)15-12-26-24(30)20-8-9-21(22-16-18(4)17-33-22)27-23(20)29-13-10-19(11-14-29)25(31)32-7-3/h8-9,16-17,19H,5-7,10-15H2,1-4H3,(H,26,30)