5-ethenyl-1-ethyl-4-oxidanylidene-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinoline-3-carboxylic acid

Systemtic Name: 5-ethenyl-1-ethyl-4-oxidanylidene-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinoline-3-carboxylic acid Openeye Name: 1-ethyl-2-(4-isopropylthiazol-2-yl)-4-oxo-5-vinyl-quinoline-3-carboxylic acid CAS Name: 5-ethenyl-1-ethyl-4-oxo-2-(4-propan-2-yl-2-thiazolyl)-3-quinolinecarboxylic acid IUPAC Name: 5-ethenyl-1-ethyl-4-oxo-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinoline-3-carboxylic acid Traditional Name: 1-ethyl-2-(4-isopropylthiazol-2-yl)-4-keto-5-vinyl-quinoline-3-carboxylic acid Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC(=C2C(=O)C(=C1C3=NC(=CS3)C(C)C)C(=O)O)C=C

Isomeric SMILES

CCN1C2=CC=CC(=C2C(=O)C(=C1C3=NC(=CS3)C(C)C)C(=O)O)C=C

InChI

InChI=1S/C20H20N2O3S/c1-5-12-8-7-9-14-15(12)18(23)16(20(24)25)17(22(14)6-2)19-21-13(10-26-19)11(3)4/h5,7-11H,1,6H2,2-4H3,(H,24,25)