3-azanyl-4-(4-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid

Systemtic Name: 3-azanyl-4-(4-fluorophenyl)-7,7-dimethyl-5-oxidanylidene-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Openeye Name: 3-amino-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid CAS Name: 3-amino-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid IUPAC Name: 3-amino-4-(4-fluorophenyl)-7,7-dimethyl-5-oxo-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Traditional Name: 3-amino-4-(4-fluorophenyl)-5-keto-7,7-dimethyl-4,6,8,9-tetrahydrothieno[2,3-b]quinoline-2-carboxylic acid Formula: C20H19FN2O3S MolecularWeight: 386.439863

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(N2)SC(=C3N)C(=O)O)C4=CC=C(C=C4)F)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(N2)SC(=C3N)C(=O)O)C4=CC=C(C=C4)F)C(=O)C1)C

InChI

InChI=1S/C20H19FN2O3S/c1-20(2)7-11-14(12(24)8-20)13(9-3-5-10(21)6-4-9)15-16(22)17(19(25)26)27-18(15)23-11/h3-6,13,23H,7-8,22H2,1-2H3,(H,25,26)