2-[5-[[4,5,7-tris(fluoranyl)-1,3-benzothiazol-2-yl]methyl]thiophen-3-yl]ethanoic acid

Systemtic Name: 2-[5-[[4,5,7-tris(fluoranyl)-1,3-benzothiazol-2-yl]methyl]thiophen-3-yl]ethanoic acid Openeye Name: 2-[5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-3-thienyl]acetic acid CAS Name: 2-[5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-3-thiophenyl]acetic acid IUPAC Name: 2-[5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]thiophen-3-yl]acetic acid Traditional Name: 2-[5-[(4,5,7-trifluoro-1,3-benzothiazol-2-yl)methyl]-3-thienyl]acetic acid Formula: C14H8F3NO2S2 MolecularWeight: 343.34403

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1CC(=O)O)CC2=NC3=C(C(=CC(=C3S2)F)F)F

Isomeric SMILES

C1=C(SC=C1CC(=O)O)CC2=NC3=C(C(=CC(=C3S2)F)F)F

InChI

InChI=1S/C14H8F3NO2S2/c15-8-4-9(16)14-13(12(8)17)18-10(22-14)3-7-1-6(5-21-7)2-11(19)20/h1,4-5H,2-3H2,(H,19,20)