4-[5-(3-azanyl-4-methyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[5-(3-azanyl-4-methyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[5-(3-amino-4-methyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[5-(3-amino-4-methylphenyl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[5-(3-amino-4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[5-(3-amino-4-methyl-phenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C17H15F3N4O2S MolecularWeight: 396.38681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)N

InChI

InChI=1S/C17H15F3N4O2S/c1-10-2-3-11(8-14(10)21)15-9-16(17(18,19)20)23-24(15)12-4-6-13(7-5-12)27(22,25)26/h2-9H,21H2,1H3,(H2,22,25,26)