3,4-dimethoxy-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 3,4-dimethoxy-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C18H16F3N3O4S MolecularWeight: 427.39755

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3C=CC=N3)OC

InChI

InChI=1S/C18H16F3N3O4S/c1-27-16-7-5-13(11-17(16)28-2)29(25,26)23-14-10-12(18(19,20)21)4-6-15(14)24-9-3-8-22-24/h3-11,23H,1-2H3