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

Systemtic Name: 3-(4-methoxyphenyl)-4-methyl-1-(3-oxidanylcyclopentyl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-1-(3-hydroxycyclopentyl)-3-(4-methoxyphenyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-1-(3-hydroxycyclopentyl)-3-(4-methoxyphenyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-1-(3-hydroxycyclopentyl)-3-(4-methoxyphenyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-1-(3-hydroxycyclopentyl)-3-(4-methoxyphenyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C25H27N5O3 MolecularWeight: 445.51358

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CN=C(N=C2N(C(=O)N1C3=CC=C(C=C3)OC)C4CCC(C4)O)NC5=CC=CC=C5

Isomeric SMILES

CC1C2=CN=C(N=C2N(C(=O)N1C3=CC=C(C=C3)OC)C4CCC(C4)O)NC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O3/c1-16-22-15-26-24(27-17-6-4-3-5-7-17)28-23(22)30(19-8-11-20(31)14-19)25(32)29(16)18-9-12-21(33-2)13-10-18/h3-7,9-10,12-13,15-16,19-20,31H,8,11,14H2,1-2H3,(H,26,27,28)