[4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2,1,3-benzothiadiazole-4-sulfonate

Systemtic Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2,1,3-benzothiadiazole-4-sulfonate Openeye Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2,1,3-benzothiadiazole-4-sulfonate CAS Name: 2,1,3-benzothiadiazole-4-sulfonic acid [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] 2,1,3-benzothiadiazole-4-sulfonate Traditional Name: piazthiole-4-sulfonic acid [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C19H14FN3O5S3 MolecularWeight: 479.524963

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CN(C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C19H14FN3O5S3/c1-23(30(24,25)17-7-3-2-5-15(17)20)13-9-11-14(12-10-13)28-31(26,27)18-8-4-6-16-19(18)22-29-21-16/h2-12H,1H3