2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]indazol-3-yl]ethanoate

Systemtic Name: 2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]indazol-3-yl]ethanoate Openeye Name: 2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]indazol-3-yl]acetate CAS Name: 2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]-3-indazolyl]acetate IUPAC Name: 2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]indazol-3-yl]acetate Traditional Name: 2-[1-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]indazol-3-yl]acetate Formula: C18H11F3N3O2S- MolecularWeight: 390.35905

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN2CC3=NC4=C(S3)C=CC(=C4)C(F)(F)F)CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN2CC3=NC4=C(S3)C=CC(=C4)C(F)(F)F)CC(=O)[O-]

InChI

InChI=1S/C18H12F3N3O2S/c19-18(20,21)10-5-6-15-13(7-10)22-16(27-15)9-24-14-4-2-1-3-11(14)12(23-24)8-17(25)26/h1-7H,8-9H2,(H,25,26)/p-1