3-[4-(2-nitrophenyl)-1,2,3-triazol-1-yl]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-[4-(2-nitrophenyl)-1,2,3-triazol-1-yl]-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-isopropyl-3-[4-(2-nitrophenyl)triazol-1-yl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-[4-(2-nitrophenyl)-1-triazolyl]-1-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-[4-(2-nitrophenyl)triazol-1-yl]-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-isopropyl-3-[4-(2-nitrophenyl)triazol-1-yl]pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C16H15N9O2 MolecularWeight: 365.3494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=NC=N2)N)C(=N1)N3C=C(N=N3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C2=C(C(=NC=N2)N)C(=N1)N3C=C(N=N3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C16H15N9O2/c1-9(2)24-15-13(14(17)18-8-19-15)16(21-24)23-7-11(20-22-23)10-5-3-4-6-12(10)25(26)27/h3-9H,1-2H3,(H2,17,18,19)