ethyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate Openeye Name: ethyl 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxyquinoline-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(2-thiazolin-2-ylthio)methyl]quinoline-3-carboxylic acid ethyl ester Formula: C26H28N2O6S2 MolecularWeight: 528.64032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CSC3=NCCS3)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CSC3=NCCS3)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H28N2O6S2/c1-6-34-25(29)24-18(14-36-26-27-9-10-35-26)28-17-13-22(33-5)21(32-4)12-16(17)23(24)15-7-8-19(30-2)20(11-15)31-3/h7-8,11-13H,6,9-10,14H2,1-5H3