methyl 1-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidin-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)-4-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)piperidine-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)isonipecotoyl]isonipecotic acid methyl ester Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)N4CCC(CC4)C(=O)OC)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)N3CCC(CC3)C(=O)N4CCC(CC4)C(=O)OC)C

InChI

InChI=1S/C21H28N4O3S/c1-13-14(2)29-19-17(13)18(22-12-23-19)24-8-4-15(5-9-24)20(26)25-10-6-16(7-11-25)21(27)28-3/h12,15-16H,4-11H2,1-3H3