N3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide Openeye Name: N3-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide CAS Name: N3-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide Traditional Name: N'-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]benzene-1,3-disulfonamide Formula: C16H13F3N4O4S2 MolecularWeight: 446.42403

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13F3N4O4S2/c17-16(18,19)11-5-6-15(23-8-2-7-21-23)14(9-11)22-29(26,27)13-4-1-3-12(10-13)28(20,24)25/h1-10,22H,(H2,20,24,25)