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

Systemtic Name: 1-cyclohexyl-3-(4-methoxyphenyl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-1-cyclohexyl-3-(4-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-1-cyclohexyl-3-(4-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-1-cyclohexyl-3-(4-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-1-cyclohexyl-3-(4-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4CCCCC4)NC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4CCCCC4)NC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2/c1-32-22-14-12-20(13-15-22)29-17-18-16-26-24(27-19-8-4-2-5-9-19)28-23(18)30(25(29)31)21-10-6-3-7-11-21/h2,4-5,8-9,12-16,21H,3,6-7,10-11,17H2,1H3,(H,26,27,28)