3-azanyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-ethoxy-thieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-ethoxy-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-ethoxy-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-ethoxy-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-ethoxythieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-ethoxy-thieno[2,3-b]quinoline-2-carboxamide Formula: C21H15ClF3N3O2S MolecularWeight: 465.87591

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

CCOC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C21H15ClF3N3O2S/c1-2-30-12-4-6-15-10(7-12)8-13-17(26)18(31-20(13)28-15)19(29)27-16-9-11(21(23,24)25)3-5-14(16)22/h3-9H,2,26H2,1H3,(H,27,29)