[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Openeye Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone CAS Name: [4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-(3-phenyl-1H-pyrazol-5-yl)methanone IUPAC Name: [4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone Traditional Name: [4-(2-nitrophenyl)sulfonylpiperazino]-(3-phenyl-1H-pyrazol-5-yl)methanone Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NN2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O5S/c26-20(17-14-16(21-22-17)15-6-2-1-3-7-15)23-10-12-24(13-11-23)31(29,30)19-9-5-4-8-18(19)25(27)28/h1-9,14H,10-13H2,(H,21,22)