4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-N-pyridin-3-yl-piperazine-1-carboxamide

Systemtic Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-N-pyridin-3-yl-piperazine-1-carboxamide Openeye Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-N-(3-pyridyl)piperazine-1-carboxamide CAS Name: 4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-N-(3-pyridinyl)-1-piperazinecarboxamide IUPAC Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-N-pyridin-3-ylpiperazine-1-carboxamide Traditional Name: 4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)-N-(3-pyridyl)piperazine-1-carboxamide Formula: C16H18N8O MolecularWeight: 338.36712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CN=CC=C4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C16H18N8O/c1-22-14-13(10-20-22)15(19-11-18-14)23-5-7-24(8-6-23)16(25)21-12-3-2-4-17-9-12/h2-4,9-11H,5-8H2,1H3,(H,21,25)