3-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-pyrimidin-4-one

Systemtic Name: 3-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-pyrimidin-4-one Openeye Name: 3-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitro-pyrimidin-4-one CAS Name: 3-ethyl-6-[4-(4-fluorophenyl)-1-piperazinyl]-2-methyl-5-nitro-4-pyrimidinone IUPAC Name: 3-ethyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-5-nitropyrimidin-4-one Traditional Name: 3-ethyl-6-[4-(4-fluorophenyl)piperazino]-2-methyl-5-nitro-pyrimidin-4-one Formula: C17H20FN5O3 MolecularWeight: 361.370803

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC(=C(C1=O)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCN1C(=NC(=C(C1=O)[N+](=O)[O-])N2CCN(CC2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C17H20FN5O3/c1-3-22-12(2)19-16(15(17(22)24)23(25)26)21-10-8-20(9-11-21)14-6-4-13(18)5-7-14/h4-7H,3,8-11H2,1-2H3