4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide Openeye Name: 4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide CAS Name: 4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide IUPAC Name: 4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide Traditional Name: 4-[3-(cyanomethoxy)-5-(4-fluorophenyl)-1,2,4-triazol-1-yl]benzenesulfonamide Formula: C16H12FN5O3S MolecularWeight: 373.361583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)OCC#N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)OCC#N)F

InChI

InChI=1S/C16H12FN5O3S/c17-12-3-1-11(2-4-12)15-20-16(25-10-9-18)21-22(15)13-5-7-14(8-6-13)26(19,23)24/h1-8H,10H2,(H2,19,23,24)