methyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Openeye Name: methyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[[(1-methyl-2-imidazolyl)thio]methyl]-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[[(1-methylimidazol-2-yl)thio]methyl]quinoline-3-carboxylic acid methyl ester Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=NC3=CC(=C(C=C3C(=C2C(=O)OC)C4=CC(=C(C=C4)OC)OC)OC)OC

Isomeric SMILES

CN1C=CN=C1SCC2=NC3=CC(=C(C=C3C(=C2C(=O)OC)C4=CC(=C(C=C4)OC)OC)OC)OC

InChI

InChI=1S/C26H27N3O6S/c1-29-10-9-27-26(29)36-14-18-24(25(30)35-6)23(15-7-8-19(31-2)20(11-15)32-3)16-12-21(33-4)22(34-5)13-17(16)28-18/h7-13H,14H2,1-6H3