1-ethyl-7-(2-methylsulfanyl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-(2-methylsulfanyl-1,3-thiazol-4-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-(2-methylsulfanylthiazol-4-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-[2-(methylthio)-4-thiazolyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-(2-methylsulfanyl-1,3-thiazol-4-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-4-keto-7-[2-(methylthio)thiazol-4-yl]quinoline-3-carboxylic acid Formula: C16H14N2O3S2 MolecularWeight: 346.42396

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CSC(=N3)SC)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=C(C=C2)C3=CSC(=N3)SC)C(=O)O

InChI

InChI=1S/C16H14N2O3S2/c1-3-18-7-11(15(20)21)14(19)10-5-4-9(6-13(10)18)12-8-23-16(17-12)22-2/h4-8H,3H2,1-2H3,(H,20,21)