N-[3-(7-azanyl-1-methyl-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloranyl-phenyl]-4-pyridin-4-yl-benzamide

Systemtic Name: N-[3-(7-azanyl-1-methyl-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloranyl-phenyl]-4-pyridin-4-yl-benzamide Openeye Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloro-phenyl]-4-(4-pyridyl)benzamide CAS Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chlorophenyl]-4-pyridin-4-ylbenzamide IUPAC Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chlorophenyl]-4-pyridin-4-ylbenzamide Traditional Name: N-[3-(7-amino-2-keto-1-methyl-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloro-phenyl]-4-(4-pyridyl)benzamide Formula: C25H20ClN7O2 MolecularWeight: 485.925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)C4=CC=C(C=C4)C5=CC=NC=C5)Cl)N

Isomeric SMILES

CN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)C4=CC=C(C=C4)C5=CC=NC=C5)Cl)N

InChI

InChI=1S/C25H20ClN7O2/c1-32-22-18(13-29-24(27)31-22)14-33(25(32)35)21-12-19(6-7-20(21)26)30-23(34)17-4-2-15(3-5-17)16-8-10-28-11-9-16/h2-13H,14H2,1H3,(H,30,34)(H2,27,29,31)