3-azanyl-6-ethyl-N-(5-fluoranyl-2-methyl-phenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: 3-azanyl-6-ethyl-N-(5-fluoranyl-2-methyl-phenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: 3-amino-6-ethyl-N-(5-fluoro-2-methyl-phenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: 3-amino-6-ethyl-N-(5-fluoro-2-methylphenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: 3-amino-6-ethyl-N-(5-fluoro-2-methylphenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: 3-amino-6-ethyl-N-(5-fluoro-2-methyl-phenyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C21H22FN3OS MolecularWeight: 383.482283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NC4=C(C=CC(=C4)F)C)N

Isomeric SMILES

CCC1CCC2=C(C1)C=C3C(=C(SC3=N2)C(=O)NC4=C(C=CC(=C4)F)C)N

InChI

InChI=1S/C21H22FN3OS/c1-3-12-5-7-16-13(8-12)9-15-18(23)19(27-21(15)25-16)20(26)24-17-10-14(22)6-4-11(17)2/h4,6,9-10,12H,3,5,7-8,23H2,1-2H3,(H,24,26)