N2-(3-methoxy-4-morpholin-4-yl-phenyl)-N4-(5-phenyl-1,2-oxazol-3-yl)pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methoxy-4-morpholin-4-yl-phenyl)-N4-(5-phenyl-1,2-oxazol-3-yl)pyrimidine-2,4-diamine Openeye Name: N2-(3-methoxy-4-morpholino-phenyl)-N4-(5-phenylisoxazol-3-yl)pyrimidine-2,4-diamine CAS Name: N2-[3-methoxy-4-(4-morpholinyl)phenyl]-N4-(5-phenyl-3-isoxazolyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methoxy-4-morpholin-4-ylphenyl)-4-N-(5-phenyl-1,2-oxazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [2-(3-methoxy-4-morpholino-anilino)pyrimidin-4-yl]-(5-phenylisoxazol-3-yl)amine Formula: C24H24N6O3 MolecularWeight: 444.48576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=CC(=N2)NC3=NOC(=C3)C4=CC=CC=C4)N5CCOCC5

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=CC(=N2)NC3=NOC(=C3)C4=CC=CC=C4)N5CCOCC5

InChI

InChI=1S/C24H24N6O3/c1-31-21-15-18(7-8-19(21)30-11-13-32-14-12-30)26-24-25-10-9-22(28-24)27-23-16-20(33-29-23)17-5-3-2-4-6-17/h2-10,15-16H,11-14H2,1H3,(H2,25,26,27,28,29)