[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)C

InChI

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