ethyl 1-[2-(dimethylamino)-6-(4-methylthiophen-2-yl)pyridin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(dimethylamino)-6-(4-methylthiophen-2-yl)pyridin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-(dimethylamino)-6-(4-methyl-2-thienyl)pyridine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(dimethylamino)-6-(4-methyl-2-thiophenyl)-3-pyridinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(dimethylamino)-6-(4-methylthiophen-2-yl)pyridine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(dimethylamino)-6-(4-methyl-2-thienyl)nicotinoyl]isonipecotic acid ethyl ester Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-5-27-21(26)15-8-10-24(11-9-15)20(25)16-6-7-17(22-19(16)23(3)4)18-12-14(2)13-28-18/h6-7,12-13,15H,5,8-11H2,1-4H3