3-azanyl-N-(2,5-dimethoxyphenyl)-6-(trifluoromethyloxy)thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-(2,5-dimethoxyphenyl)-6-(trifluoromethyloxy)thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-(2,5-dimethoxyphenyl)-6-(trifluoromethoxy)thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-(2,5-dimethoxyphenyl)-6-(trifluoromethoxy)-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-(2,5-dimethoxyphenyl)-6-(trifluoromethoxy)thieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-(2,5-dimethoxyphenyl)-6-(trifluoromethoxy)thieno[2,3-b]quinoline-2-carboxamide Formula: C21H16F3N3O4S MolecularWeight: 463.42965

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C3=C(S2)N=C4C=CC(=CC4=C3)OC(F)(F)F)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(C3=C(S2)N=C4C=CC(=CC4=C3)OC(F)(F)F)N

InChI

InChI=1S/C21H16F3N3O4S/c1-29-11-4-6-16(30-2)15(9-11)26-19(28)18-17(25)13-8-10-7-12(31-21(22,23)24)3-5-14(10)27-20(13)32-18/h3-9H,25H2,1-2H3,(H,26,28)