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

Systemtic Name: 3-azanyl-N-[2-chloranyl-5-(trifluoromethyl)phenyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-2-thieno[2,3-b]quinolinecarboxamide IUPAC Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxythieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-N-[2-chloro-5-(trifluoromethyl)phenyl]-6-methoxy-thieno[2,3-b]quinoline-2-carboxamide Formula: C20H13ClF3N3O2S MolecularWeight: 451.84933

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC2=CC3=C(N=C2C=C1)SC(=C3N)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)Cl

InChI

InChI=1S/C20H13ClF3N3O2S/c1-29-11-3-5-14-9(6-11)7-12-16(25)17(30-19(12)27-14)18(28)26-15-8-10(20(22,23)24)2-4-13(15)21/h2-8H,25H2,1H3,(H,26,28)