ethyl 1-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-2-carboxylate

Systemtic Name: ethyl 1-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl 1-[5-methyl-4-[4-(2-pyridyl)piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carbonyl]piperidine-2-carboxylate CAS Name: 1-[[5-methyl-4-[4-(2-pyridinyl)-1-piperazinyl]-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-methyl-4-(4-pyridin-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carbonyl]piperidine-2-carboxylate Traditional Name: 1-[5-methyl-4-[4-(2-pyridyl)piperazino]thieno[2,3-d]pyrimidine-6-carbonyl]pipecolinic acid ethyl ester Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C5=CC=CC=N5)C

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)C2=C(C3=C(N=CN=C3S2)N4CCN(CC4)C5=CC=CC=N5)C

InChI

InChI=1S/C25H30N6O3S/c1-3-34-25(33)18-8-5-7-11-31(18)24(32)21-17(2)20-22(27-16-28-23(20)35-21)30-14-12-29(13-15-30)19-9-4-6-10-26-19/h4,6,9-10,16,18H,3,5,7-8,11-15H2,1-2H3