ethyl 2-phenyl-4-[[2-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]amino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-phenyl-4-[[2-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]amino]pyrimidine-5-carboxylate Openeye Name: ethyl 2-phenyl-4-[[2-[2-(2-pyridyl)ethylamino]pyrimidin-4-yl]amino]pyrimidine-5-carboxylate CAS Name: 2-phenyl-4-[[2-[2-(2-pyridinyl)ethylamino]-4-pyrimidinyl]amino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-phenyl-4-[[2-(2-pyridin-2-ylethylamino)pyrimidin-4-yl]amino]pyrimidine-5-carboxylate Traditional Name: 2-phenyl-4-[[2-[2-(2-pyridyl)ethylamino]pyrimidin-4-yl]amino]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H23N7O2 MolecularWeight: 441.48512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=NC(=NC=C2)NCCC3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=NC(=NC=C2)NCCC3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N7O2/c1-2-33-23(32)19-16-28-21(17-8-4-3-5-9-17)31-22(19)29-20-12-15-27-24(30-20)26-14-11-18-10-6-7-13-25-18/h3-10,12-13,15-16H,2,11,14H2,1H3,(H2,26,27,28,29,30,31)