4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2,6-bis(fluoranyl)benzaldehyde

Systemtic Name: 4-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2,6-bis(fluoranyl)benzaldehyde Openeye Name: 4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2,6-difluoro-benzaldehyde CAS Name: 4-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-2,6-difluorobenzaldehyde IUPAC Name: 4-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2,6-difluorobenzaldehyde Traditional Name: 4-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-2,6-difluoro-benzaldehyde Formula: C15H13F2N5O MolecularWeight: 317.293426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C3=CC(=C(C(=C3)F)C=O)F)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C3=CC(=C(C(=C3)F)C=O)F)C(=NC=N2)N

InChI

InChI=1S/C15H13F2N5O/c1-7(2)22-15-12(14(18)19-6-20-15)13(21-22)8-3-10(16)9(5-23)11(17)4-8/h3-7H,1-2H3,(H2,18,19,20)