4-[[5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]-8-methoxy-quinoline-2-carboxylic acid

Systemtic Name: 4-[[5-(2-ethoxy-2-oxidanylidene-ethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]-8-methoxy-quinoline-2-carboxylic acid Openeye Name: 4-[5-(2-ethoxy-2-oxo-ethyl)-4-methyl-thiazol-2-yl]sulfanyl-8-methoxy-quinoline-2-carboxylic acid CAS Name: 4-[[5-(2-ethoxy-2-oxoethyl)-4-methyl-2-thiazolyl]thio]-8-methoxy-2-quinolinecarboxylic acid IUPAC Name: 4-[[5-(2-ethoxy-2-oxoethyl)-4-methyl-1,3-thiazol-2-yl]sulfanyl]-8-methoxyquinoline-2-carboxylic acid Traditional Name: 4-[[5-(2-ethoxy-2-keto-ethyl)-4-methyl-thiazol-2-yl]thio]-8-methoxy-quinaldic acid Formula: C19H18N2O5S2 MolecularWeight: 418.48662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=C(S1)SC2=CC(=NC3=C2C=CC=C3OC)C(=O)O)C

Isomeric SMILES

CCOC(=O)CC1=C(N=C(S1)SC2=CC(=NC3=C2C=CC=C3OC)C(=O)O)C

InChI

InChI=1S/C19H18N2O5S2/c1-4-26-16(22)9-14-10(2)20-19(27-14)28-15-8-12(18(23)24)21-17-11(15)6-5-7-13(17)25-3/h5-8H,4,9H2,1-3H3,(H,23,24)