1-[5-methyl-1-(3-nitrophenyl)-3-(phenylsulfonyl)pyrazol-4-yl]ethanone

Systemtic Name: 1-[5-methyl-1-(3-nitrophenyl)-3-(phenylsulfonyl)pyrazol-4-yl]ethanone Openeye Name: 1-[3-(benzenesulfonyl)-5-methyl-1-(3-nitrophenyl)pyrazol-4-yl]ethanone CAS Name: 1-[3-(benzenesulfonyl)-5-methyl-1-(3-nitrophenyl)-4-pyrazolyl]ethanone IUPAC Name: 1-[3-(benzenesulfonyl)-5-methyl-1-(3-nitrophenyl)pyrazol-4-yl]ethanone Traditional Name: 1-[3-besyl-5-methyl-1-(3-nitrophenyl)pyrazol-4-yl]ethanone Formula: C18H15N3O5S MolecularWeight: 385.3938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C18H15N3O5S/c1-12-17(13(2)22)18(27(25,26)16-9-4-3-5-10-16)19-20(12)14-7-6-8-15(11-14)21(23)24/h3-11H,1-2H3