5-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-(3-chloro-4-methoxyphenyl)-2-oxoethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H15ClN4O3 MolecularWeight: 394.8111

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H15ClN4O3/c1-28-18-8-7-13(9-16(18)21)17(26)11-24-12-22-19-15(20(24)27)10-23-25(19)14-5-3-2-4-6-14/h2-10,12H,11H2,1H3