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

Systemtic Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(3-methylpiperidin-1-yl)-5-nitro-pyrimidine Openeye Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(3-methyl-1-piperidyl)-5-nitro-pyrimidine CAS Name: 4-[4-(4-fluorophenyl)-1-piperazinyl]-6-(3-methyl-1-piperidinyl)-5-nitropyrimidine IUPAC Name: 4-[4-(4-fluorophenyl)piperazin-1-yl]-6-(3-methylpiperidin-1-yl)-5-nitropyrimidine Traditional Name: 4-[4-(4-fluorophenyl)piperazino]-6-(3-methylpiperidino)-5-nitro-pyrimidine Formula: C20H25FN6O2 MolecularWeight: 400.449903

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C(=NC=N2)N3CCN(CC3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C20H25FN6O2/c1-15-3-2-8-26(13-15)20-18(27(28)29)19(22-14-23-20)25-11-9-24(10-12-25)17-6-4-16(21)5-7-17/h4-7,14-15H,2-3,8-13H2,1H3