2-azanyl-N-[3-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenyl-ethanamide; ethanoic acid

Systemtic Name: 2-azanyl-N-[3-(4-methoxyphenyl)-2-oxidanylidene-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenyl-ethanamide; ethanoic acid Openeye Name: acetic acid; 2-amino-N-[3-(4-methoxyphenyl)-2-oxo-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenyl-acetamide CAS Name: acetic acid; 2-amino-N-[3-(4-methoxyphenyl)-2-oxo-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenylacetamide IUPAC Name: acetic acid; 2-amino-N-[3-(4-methoxyphenyl)-2-oxo-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenylacetamide Traditional Name: acetic acid; 2-amino-N-[2-keto-3-(4-methoxyphenyl)-1-phenyl-4H-pyrimido[4,5-d]pyrimidin-7-yl]-N-phenyl-acetamide Formula: C29H28N6O5 MolecularWeight: 540.56982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)N(C5=CC=CC=C5)C(=O)CN

Isomeric SMILES

CC(=O)O.COC1=CC=C(C=C1)N2CC3=CN=C(N=C3N(C2=O)C4=CC=CC=C4)N(C5=CC=CC=C5)C(=O)CN

InChI

InChI=1S/C27H24N6O3.C2H4O2/c1-36-23-14-12-20(13-15-23)31-18-19-17-29-26(32(24(34)16-28)21-8-4-2-5-9-21)30-25(19)33(27(31)35)22-10-6-3-7-11-22;1-2(3)4/h2-15,17H,16,18,28H2,1H3;1H3,(H,3,4)