3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]-6-(trifluoromethyl)pyridin-2-olate

Systemtic Name: 3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]-6-(trifluoromethyl)pyridin-2-olate Openeye Name: 3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]-6-(trifluoromethyl)pyridin-2-olate CAS Name: 3-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]-oxomethyl]-6-(trifluoromethyl)-2-pyridinolate IUPAC Name: 3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]-6-(trifluoromethyl)pyridin-2-olate Traditional Name: 3-[1,3-benzothiazol-2-ylmethyl(methyl)carbamoyl]-6-(trifluoromethyl)pyridin-2-olate Formula: C16H11F3N3O2S- MolecularWeight: 366.33765

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(N=C(C=C3)C(F)(F)F)[O-]

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)C3=C(N=C(C=C3)C(F)(F)F)[O-]

InChI

InChI=1S/C16H12F3N3O2S/c1-22(8-13-20-10-4-2-3-5-11(10)25-13)15(24)9-6-7-12(16(17,18)19)21-14(9)23/h2-7H,8H2,1H3,(H,21,23)/p-1