N-[3-[5-(3-fluorophenyl)-1-methyl-pyrazol-3-yl]propyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-[5-(3-fluorophenyl)-1-methyl-pyrazol-3-yl]propyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-[5-(3-fluorophenyl)-1-methyl-pyrazol-3-yl]propyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide CAS Name: N-[3-[5-(3-fluorophenyl)-1-methyl-3-pyrazolyl]propyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-[5-(3-fluorophenyl)-1-methylpyrazol-3-yl]propyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[3-[5-(3-fluorophenyl)-1-methyl-pyrazol-3-yl]propyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide Formula: C22H25FN4O4S MolecularWeight: 460.521703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CCCC2=NN(C(=C2)C3=CC(=CC=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CCCC2=NN(C(=C2)C3=CC(=CC=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C22H25FN4O4S/c1-15-11-20(27(28)29)14-22(16(15)2)32(30,31)25(3)10-6-9-19-13-21(26(4)24-19)17-7-5-8-18(23)12-17/h5,7-8,11-14H,6,9-10H2,1-4H3