4-(3,5-dimethylpyrazol-1-yl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidine

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidine Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitro-pyrimidine CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-6-[4-(4-fluorophenyl)-1-piperazinyl]-5-nitropyrimidine IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-6-[4-(4-fluorophenyl)piperazin-1-yl]-5-nitropyrimidine Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-6-[4-(4-fluorophenyl)piperazino]-5-nitro-pyrimidine Formula: C19H20FN7O2 MolecularWeight: 397.406203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=C(C=C4)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=C(C=C4)F)[N+](=O)[O-])C

InChI

InChI=1S/C19H20FN7O2/c1-13-11-14(2)26(23-13)19-17(27(28)29)18(21-12-22-19)25-9-7-24(8-10-25)16-5-3-15(20)4-6-16/h3-6,11-12H,7-10H2,1-2H3