3-(2-bromophenyl)-1-(cyclohexylmethyl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(2-bromophenyl)-1-(cyclohexylmethyl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-3-(2-bromophenyl)-1-(cyclohexylmethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-3-(2-bromophenyl)-1-(cyclohexylmethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-3-(2-bromophenyl)-1-(cyclohexylmethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-3-(2-bromophenyl)-1-(cyclohexylmethyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C25H26BrN5O MolecularWeight: 492.41084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=NC(=NC=C3CN(C2=O)C4=CC=CC=C4Br)NC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CN2C3=NC(=NC=C3CN(C2=O)C4=CC=CC=C4Br)NC5=CC=CC=C5

InChI

InChI=1S/C25H26BrN5O/c26-21-13-7-8-14-22(21)30-17-19-15-27-24(28-20-11-5-2-6-12-20)29-23(19)31(25(30)32)16-18-9-3-1-4-10-18/h2,5-8,11-15,18H,1,3-4,9-10,16-17H2,(H,27,28,29)