N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]-3-(trifluoromethoxy)benzenesulfonamide Formula: C16H13F3N4O3S MolecularWeight: 398.35963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=CC=C(C=C2)CN3C=NC=N3)OC(F)(F)F

InChI

InChI=1S/C16H13F3N4O3S/c17-16(18,19)26-14-2-1-3-15(8-14)27(24,25)22-13-6-4-12(5-7-13)9-23-11-20-10-21-23/h1-8,10-11,22H,9H2