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

Systemtic Name: 3-[3-(4-methoxyphenyl)-2-oxidanylidene-7-phenylazanyl-4H-pyrimido[4,5-d]pyrimidin-1-yl]propanamide Openeye Name: 3-[7-anilino-3-(4-methoxyphenyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-1-yl]propanamide CAS Name: 3-[7-anilino-3-(4-methoxyphenyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-1-yl]propanamide IUPAC Name: 3-[7-anilino-3-(4-methoxyphenyl)-2-oxo-4H-pyrimido[4,5-d]pyrimidin-1-yl]propanamide Traditional Name: 3-[7-anilino-2-keto-3-(4-methoxyphenyl)-4H-pyrimido[4,5-d]pyrimidin-1-yl]propionamide Formula: C22H22N6O3 MolecularWeight: 418.44848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)CCC(=O)N)NC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)CCC(=O)N)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N6O3/c1-31-18-9-7-17(8-10-18)28-14-15-13-24-21(25-16-5-3-2-4-6-16)26-20(15)27(22(28)30)12-11-19(23)29/h2-10,13H,11-12,14H2,1H3,(H2,23,29)(H,24,25,26)