4-[3-fluoranyl-4-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid

Systemtic Name: 4-[3-fluoranyl-4-[(6-fluoranyl-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid Openeye Name: 4-[3-fluoro-4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid CAS Name: 4-[3-fluoro-4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid IUPAC Name: 4-[3-fluoro-4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid Traditional Name: 4-[3-fluoro-4-[(6-fluoro-1,3-benzothiazol-2-yl)amino]phenyl]benzoic acid Formula: C20H12F2N2O2S MolecularWeight: 382.383286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(C=C2)NC3=NC4=C(S3)C=C(C=C4)F)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(C=C2)NC3=NC4=C(S3)C=C(C=C4)F)F)C(=O)O

InChI

InChI=1S/C20H12F2N2O2S/c21-14-6-8-17-18(10-14)27-20(24-17)23-16-7-5-13(9-15(16)22)11-1-3-12(4-2-11)19(25)26/h1-10H,(H,23,24)(H,25,26)