ethyl 4-(5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(5-phenyl-2-pyridin-3-yl-thieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[5-phenyl-2-(3-pyridinyl)-4-thieno[2,3-d]pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(5-phenyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-[5-phenyl-2-(3-pyridyl)thieno[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C24H23N5O2S MolecularWeight: 445.53672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C3C(=CSC3=NC(=N2)C4=CN=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H23N5O2S/c1-2-31-24(30)29-13-11-28(12-14-29)22-20-19(17-7-4-3-5-8-17)16-32-23(20)27-21(26-22)18-9-6-10-25-15-18/h3-10,15-16H,2,11-14H2,1H3