methyl 1-ethyl-4-oxidanylidene-5-[(E)-2-(4-propan-2-yl-1,3-thiazol-2-yl)ethenyl]quinoline-2-carboxylate

Systemtic Name: methyl 1-ethyl-4-oxidanylidene-5-[(E)-2-(4-propan-2-yl-1,3-thiazol-2-yl)ethenyl]quinoline-2-carboxylate Openeye Name: methyl 1-ethyl-5-[(E)-2-(4-isopropylthiazol-2-yl)vinyl]-4-oxo-quinoline-2-carboxylate CAS Name: 1-ethyl-4-oxo-5-[(E)-2-(4-propan-2-yl-2-thiazolyl)ethenyl]-2-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-oxo-5-[(E)-2-(4-propan-2-yl-1,3-thiazol-2-yl)ethenyl]quinoline-2-carboxylate Traditional Name: 1-ethyl-5-[(E)-2-(4-isopropylthiazol-2-yl)vinyl]-4-keto-quinaldic acid methyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC(=C2C(=O)C=C1C(=O)OC)C=CC3=NC(=CS3)C(C)C

Isomeric SMILES

CCN1C2=CC=CC(=C2C(=O)C=C1C(=O)OC)/C=C/C3=NC(=CS3)C(C)C

InChI

InChI=1S/C21H22N2O3S/c1-5-23-16-8-6-7-14(9-10-19-22-15(12-27-19)13(2)3)20(16)18(24)11-17(23)21(25)26-4/h6-13H,5H2,1-4H3/b10-9+