N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-morpholin-4-yl-pyrimido[5,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(3-chloranyl-4-fluoranyl-phenyl)-N6-morpholin-4-yl-pyrimido[5,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(3-chloro-4-fluoro-phenyl)-N6-morpholino-pyrimido[5,4-d]pyrimidine-4,6-diamine CAS Name: N4-(3-chloro-4-fluorophenyl)-N6-(4-morpholinyl)pyrimido[5,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(3-chloro-4-fluorophenyl)-6-N-morpholin-4-ylpyrimido[5,4-d]pyrimidine-4,6-diamine Traditional Name: [4-(3-chloro-4-fluoro-anilino)pyrimido[5,4-d]pyrimidin-6-yl]-morpholino-amine Formula: C16H15ClFN7O MolecularWeight: 375.788003

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1COCCN1NC2=NC=C3C(=N2)C(=NC=N3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C16H15ClFN7O/c17-11-7-10(1-2-12(11)18)22-15-14-13(20-9-21-15)8-19-16(23-14)24-25-3-5-26-6-4-25/h1-2,7-9H,3-6H2,(H,19,23,24)(H,20,21,22)