7-azanyl-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 7-azanyl-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-amino-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-amino-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-amino-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-amino-3-(2-bromophenyl)-1-[3-(2-hydroxyethyl)phenyl]-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C20H18BrN5O2 MolecularWeight: 440.29322

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CN=C(N=C2N(C(=O)N1C3=CC=CC=C3Br)C4=CC=CC(=C4)CCO)N

Isomeric SMILES

C1C2=CN=C(N=C2N(C(=O)N1C3=CC=CC=C3Br)C4=CC=CC(=C4)CCO)N

InChI

InChI=1S/C20H18BrN5O2/c21-16-6-1-2-7-17(16)25-12-14-11-23-19(22)24-18(14)26(20(25)28)15-5-3-4-13(10-15)8-9-27/h1-7,10-11,27H,8-9,12H2,(H2,22,23,24)