[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [5-(4-fluorophenyl)-1H-pyrazol-4-yl]-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C20H18FN5O5S MolecularWeight: 459.450823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(NN=C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O5S/c21-15-7-5-14(6-8-15)19-16(13-22-23-19)20(27)24-9-11-25(12-10-24)32(30,31)18-4-2-1-3-17(18)26(28)29/h1-8,13H,9-12H2,(H,22,23)