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

Systemtic Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (5-ethyl-1-phenyl-4-pyrazolyl)-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (5-ethyl-1-phenylpyrazol-4-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (5-ethyl-1-phenyl-pyrazol-4-yl)-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H23N5O5S/c1-2-19-18(16-23-26(19)17-8-4-3-5-9-17)22(28)24-12-14-25(15-13-24)33(31,32)21-11-7-6-10-20(21)27(29)30/h3-11,16H,2,12-15H2,1H3