2-[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazol-6-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazol-6-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazole-6-carbonyl]amino]acetic acid CAS Name: 2-[[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazol-6-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazole-6-carbonyl]amino]acetic acid Traditional Name: 2-[[2-[(4-fluorophenyl)sulfonylamino]-1,3-benzothiazole-6-carbonyl]amino]acetic acid Formula: C16H12FN3O5S2 MolecularWeight: 409.411983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1F)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1F)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)O

InChI

InChI=1S/C16H12FN3O5S2/c17-10-2-4-11(5-3-10)27(24,25)20-16-19-12-6-1-9(7-13(12)26-16)15(23)18-8-14(21)22/h1-7H,8H2,(H,18,23)(H,19,20)(H,21,22)