ethyl 4-[2-phenyl-6-(5-thiophen-2-ylpyridin-3-yl)pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-phenyl-6-(5-thiophen-2-ylpyridin-3-yl)pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-phenyl-6-[5-(2-thienyl)-3-pyridyl]pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[2-phenyl-6-(5-thiophen-2-yl-3-pyridinyl)-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-phenyl-6-(5-thiophen-2-ylpyridin-3-yl)pyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[2-phenyl-6-[5-(2-thienyl)-3-pyridyl]pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC(=CN=C3)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC(=CN=C3)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5O2S/c1-2-33-26(32)31-12-10-30(11-13-31)24-16-22(28-25(29-24)19-7-4-3-5-8-19)20-15-21(18-27-17-20)23-9-6-14-34-23/h3-9,14-18H,2,10-13H2,1H3