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

Systemtic Name: N-[3-(7-azanyl-1-methyl-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloranyl-phenyl]-2-pyridin-3-yl-ethanamide Openeye Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloro-phenyl]-2-(3-pyridyl)acetamide CAS Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chlorophenyl]-2-(3-pyridinyl)acetamide IUPAC Name: N-[3-(7-amino-1-methyl-2-oxo-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chlorophenyl]-2-pyridin-3-ylacetamide Traditional Name: N-[3-(7-amino-2-keto-1-methyl-4H-pyrimido[4,5-d]pyrimidin-3-yl)-4-chloro-phenyl]-2-(3-pyridyl)acetamide Formula: C20H18ClN7O2 MolecularWeight: 423.85562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)CC4=CN=CC=C4)Cl)N

Isomeric SMILES

CN1C2=NC(=NC=C2CN(C1=O)C3=C(C=CC(=C3)NC(=O)CC4=CN=CC=C4)Cl)N

InChI

InChI=1S/C20H18ClN7O2/c1-27-18-13(10-24-19(22)26-18)11-28(20(27)30)16-8-14(4-5-15(16)21)25-17(29)7-12-3-2-6-23-9-12/h2-6,8-10H,7,11H2,1H3,(H,25,29)(H2,22,24,26)