[3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-5-phenyl-pyrazol-4-yl]-phenyl-methanone

Systemtic Name: [3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-5-phenyl-pyrazol-4-yl]-phenyl-methanone Openeye Name: [1-(4-nitrophenyl)-5-phenyl-3-(p-tolylsulfonyl)pyrazol-4-yl]-phenyl-methanone CAS Name: [3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-5-phenyl-4-pyrazolyl]-phenylmethanone IUPAC Name: [3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)-5-phenylpyrazol-4-yl]-phenylmethanone Traditional Name: [1-(4-nitrophenyl)-5-phenyl-3-tosyl-pyrazol-4-yl]-phenyl-methanone Formula: C29H21N3O5S MolecularWeight: 523.55914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NN(C(=C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NN(C(=C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H21N3O5S/c1-20-12-18-25(19-13-20)38(36,37)29-26(28(33)22-10-6-3-7-11-22)27(21-8-4-2-5-9-21)31(30-29)23-14-16-24(17-15-23)32(34)35/h2-19H,1H3