4-[[5-azanyl-1-(2-fluorophenyl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-1-(2-fluorophenyl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-amino-1-(2-fluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[5-amino-1-[(2-fluorophenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(2-fluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-amino-1-(2-fluorobenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C15H13FN6O3S MolecularWeight: 376.365523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N)F

InChI

InChI=1S/C15H13FN6O3S/c16-12-4-2-1-3-11(12)13(23)22-14(17)20-15(21-22)19-9-5-7-10(8-6-9)26(18,24)25/h1-8H,(H2,18,24,25)(H3,17,19,20,21)