[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C21H20FN5O6S MolecularWeight: 489.476803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C21H20FN5O6S/c1-33-19-7-6-16(12-18(19)27(29)30)34(31,32)26-10-8-25(9-11-26)21(28)17-13-23-24-20(17)14-2-4-15(22)5-3-14/h2-7,12-13H,8-11H2,1H3,(H,23,24)