1,4,6-trimethyl-3-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-pyrazolo[3,4-b]pyridine

Systemtic Name: 1,4,6-trimethyl-3-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-pyrazolo[3,4-b]pyridine Openeye Name: 1,4,6-trimethyl-3-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-pyrazolo[3,4-b]pyridine CAS Name: 1,4,6-trimethyl-3-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]pyrazolo[3,4-b]pyridine IUPAC Name: 1,4,6-trimethyl-3-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxypyrazolo[3,4-b]pyridine Traditional Name: 1,4,6-trimethyl-3-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxy-pyrazolo[3,4-b]pyridine Formula: C18H22N8O3 MolecularWeight: 398.41908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=NN2C)OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=NN2C)OC3=NC=NC(=C3[N+](=O)[O-])N4CCN(CC4)C)C

InChI

InChI=1S/C18H22N8O3/c1-11-9-12(2)21-15-13(11)17(22-24(15)4)29-18-14(26(27)28)16(19-10-20-18)25-7-5-23(3)6-8-25/h9-10H,5-8H2,1-4H3