N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-6-cyclopropyl-N-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-6-cyclopropyl-N-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-6-cyclopropyl-1-isopropyl-N-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-6-cyclopropyl-N-methyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-6-cyclopropyl-N-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-6-cyclopropyl-1-isopropyl-N-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H29N7O3 MolecularWeight: 439.51076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4)N

InChI

InChI=1S/C22H29N7O3/c1-5-6-9-28-18(23)17(20(30)26-22(28)32)27(4)21(31)14-10-16(13-7-8-13)25-19-15(14)11-24-29(19)12(2)3/h10-13H,5-9,23H2,1-4H3,(H,26,30,32)