3-azanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate

Systemtic Name: 3-azanyl-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate Openeye Name: 3-amino-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate CAS Name: 3-amino-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate IUPAC Name: 3-amino-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate Traditional Name: 3-amino-4-(trifluoromethyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxylate Formula: C13H10F3N2O2S- MolecularWeight: 315.29091

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)[O-])N)C(F)(F)F

Isomeric SMILES

C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)[O-])N)C(F)(F)F

InChI

InChI=1S/C13H11F3N2O2S/c14-13(15,16)8-5-3-1-2-4-6(5)18-11-7(8)9(17)10(21-11)12(19)20/h1-4,17H2,(H,19,20)/p-1