4-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]carbonyl-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one

Systemtic Name: 4-[4-(3-chlorophenyl)carbonylpiperazin-1-yl]carbonyl-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Openeye Name: 4-[4-(3-chlorobenzoyl)piperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one CAS Name: 4-[[4-[(3-chlorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one IUPAC Name: 4-[4-(3-chlorobenzoyl)piperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Traditional Name: 4-[4-(3-chlorobenzoyl)piperazine-1-carbonyl]-1,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one Formula: C20H20ClN5O3 MolecularWeight: 413.8575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C(=O)NN2C

Isomeric SMILES

CC1=NC2=C(C(=C1)C(=O)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Cl)C(=O)NN2C

InChI

InChI=1S/C20H20ClN5O3/c1-12-10-15(16-17(22-12)24(2)23-18(16)27)20(29)26-8-6-25(7-9-26)19(28)13-4-3-5-14(21)11-13/h3-5,10-11H,6-9H2,1-2H3,(H,23,27)