3-azanyl-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide

Systemtic Name: 3-azanyl-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Openeye Name: 3-amino-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide CAS Name: 3-amino-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)-2-thieno[2,3-b]pyridin-7-iumcarboxamide IUPAC Name: 3-amino-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Traditional Name: 3-amino-N-(2,5-dimethylphenyl)-4-methyl-6-(trifluoromethyl)thieno[2,3-b]pyridin-7-ium-2-carboxamide Formula: C18H17F3N3OS+ MolecularWeight: 380.40729

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C3=C(S2)[NH+]=C(C=C3C)C(F)(F)F)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=C(C3=C(S2)[NH+]=C(C=C3C)C(F)(F)F)N

InChI

InChI=1S/C18H16F3N3OS/c1-8-4-5-9(2)11(6-8)23-16(25)15-14(22)13-10(3)7-12(18(19,20)21)24-17(13)26-15/h4-7H,22H2,1-3H3,(H,23,25)/p+1