1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinolin-3-yl]ethanone

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinolin-3-yl]ethanone Openeye Name: 1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-quinolyl]ethanone CAS Name: 1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[[(1-methyl-2-imidazolyl)thio]methyl]-3-quinolinyl]ethanone IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinolin-3-yl]ethanone Traditional Name: 1-[4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[[(1-methylimidazol-2-yl)thio]methyl]-3-quinolyl]ethanone Formula: C26H27N3O5S MolecularWeight: 493.57468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=CC(=C(C=C2N=C1CSC3=NC=CN3C)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(=O)C1=C(C2=CC(=C(C=C2N=C1CSC3=NC=CN3C)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H27N3O5S/c1-15(30)24-19(14-35-26-27-9-10-29(26)2)28-18-13-23(34-6)22(33-5)12-17(18)25(24)16-7-8-20(31-3)21(11-16)32-4/h7-13H,14H2,1-6H3