ethyl 2-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[[4-(2-ethoxy-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[[4-(2-ethoxy-2-oxo-ethyl)thiazol-2-yl]sulfanylmethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[[4-(2-ethoxy-2-oxoethyl)-2-thiazolyl]thio]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-ethoxy-2-oxoethyl)-1,3-thiazol-2-yl]sulfanylmethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[[4-(2-ethoxy-2-keto-ethyl)thiazol-2-yl]thio]methyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C21H22N2O4S2 MolecularWeight: 430.54038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC2=NC3=CC=CC=C3C(=C2C(=O)OCC)C

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC2=NC3=CC=CC=C3C(=C2C(=O)OCC)C

InChI

InChI=1S/C21H22N2O4S2/c1-4-26-18(24)10-14-11-28-21(22-14)29-12-17-19(20(25)27-5-2)13(3)15-8-6-7-9-16(15)23-17/h6-9,11H,4-5,10,12H2,1-3H3