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

Systemtic Name: 3-(4-methoxyphenyl)-7-phenylazanyl-1-piperidin-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-3-(4-methoxyphenyl)-1-(3-piperidyl)-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-3-(4-methoxyphenyl)-1-(3-piperidinyl)-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-3-(4-methoxyphenyl)-1-piperidin-3-yl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-3-(4-methoxyphenyl)-1-(3-piperidyl)-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C24H26N6O2 MolecularWeight: 430.50224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4CCCNC4)NC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4CCCNC4)NC5=CC=CC=C5

InChI

InChI=1S/C24H26N6O2/c1-32-21-11-9-19(10-12-21)29-16-17-14-26-23(27-18-6-3-2-4-7-18)28-22(17)30(24(29)31)20-8-5-13-25-15-20/h2-4,6-7,9-12,14,20,25H,5,8,13,15-16H2,1H3,(H,26,27,28)