6-[3,5-bis(bromanyl)pyridin-4-yl]-8-methyl-2-[(4-morpholin-4-ylphenyl)amino]pteridin-7-one

Systemtic Name: 6-[3,5-bis(bromanyl)pyridin-4-yl]-8-methyl-2-[(4-morpholin-4-ylphenyl)amino]pteridin-7-one Openeye Name: 6-(3,5-dibromo-4-pyridyl)-8-methyl-2-(4-morpholinoanilino)pteridin-7-one CAS Name: 6-(3,5-dibromo-4-pyridinyl)-8-methyl-2-[4-(4-morpholinyl)anilino]-7-pteridinone IUPAC Name: 6-(3,5-dibromopyridin-4-yl)-8-methyl-2-(4-morpholin-4-ylanilino)pteridin-7-one Traditional Name: 6-(3,5-dibromo-4-pyridyl)-8-methyl-2-(4-morpholinoanilino)pteridin-7-one Formula: C22H19Br2N7O2 MolecularWeight: 573.23996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2N=C(C1=O)C3=C(C=NC=C3Br)Br)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

CN1C2=NC(=NC=C2N=C(C1=O)C3=C(C=NC=C3Br)Br)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C22H19Br2N7O2/c1-30-20-17(28-19(21(30)32)18-15(23)10-25-11-16(18)24)12-26-22(29-20)27-13-2-4-14(5-3-13)31-6-8-33-9-7-31/h2-5,10-12H,6-9H2,1H3,(H,26,27,29)