3-(4-chlorophenyl)-4-methyl-1-(1-oxidanylpropan-2-yl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one

Systemtic Name: 3-(4-chlorophenyl)-4-methyl-1-(1-oxidanylpropan-2-yl)-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-2-one Openeye Name: 7-anilino-3-(4-chlorophenyl)-1-(2-hydroxy-1-methyl-ethyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one CAS Name: 7-anilino-3-(4-chlorophenyl)-1-(1-hydroxypropan-2-yl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one IUPAC Name: 7-anilino-3-(4-chlorophenyl)-1-(1-hydroxypropan-2-yl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one Traditional Name: 7-anilino-3-(4-chlorophenyl)-1-(2-hydroxy-1-methyl-ethyl)-4-methyl-4H-pyrimido[4,5-d]pyrimidin-2-one Formula: C22H22ClN5O2 MolecularWeight: 423.89538

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CN=C(N=C2N(C(=O)N1C3=CC=C(C=C3)Cl)C(C)CO)NC4=CC=CC=C4

Isomeric SMILES

CC1C2=CN=C(N=C2N(C(=O)N1C3=CC=C(C=C3)Cl)C(C)CO)NC4=CC=CC=C4

InChI

InChI=1S/C22H22ClN5O2/c1-14(13-29)27-20-19(12-24-21(26-20)25-17-6-4-3-5-7-17)15(2)28(22(27)30)18-10-8-16(23)9-11-18/h3-12,14-15,29H,13H2,1-2H3,(H,24,25,26)