3-azanyl-6-(furan-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide

Systemtic Name: 3-azanyl-6-(furan-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Openeye Name: 3-amino-6-(2-furyl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide CAS Name: 3-amino-6-(2-furanyl)-4-(trifluoromethyl)-2-thieno[2,3-b]pyridin-7-iumcarboxamide IUPAC Name: 3-amino-6-(furan-2-yl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Traditional Name: 3-amino-6-(2-furyl)-4-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Formula: C13H9F3N3O2S+ MolecularWeight: 328.28967

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=[NH+]C3=C(C(=C2)C(F)(F)F)C(=C(S3)C(=O)N)N

Isomeric SMILES

C1=COC(=C1)C2=[NH+]C3=C(C(=C2)C(F)(F)F)C(=C(S3)C(=O)N)N

InChI

InChI=1S/C13H8F3N3O2S/c14-13(15,16)5-4-6(7-2-1-3-21-7)19-12-8(5)9(17)10(22-12)11(18)20/h1-4H,17H2,(H2,18,20)/p+1