ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate Openeye Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate CAS Name: 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxyquinoline-3-carboxylate Traditional Name: 2-(1H-benzimidazol-2-ylsulfinylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C30H29N3O7S MolecularWeight: 575.63216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CS(=O)C3=NC4=CC=CC=C4N3)OC)OC)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CS(=O)C3=NC4=CC=CC=C4N3)OC)OC)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C30H29N3O7S/c1-6-40-29(34)28-22(16-41(35)30-32-19-9-7-8-10-20(19)33-30)31-21-15-26(39-5)25(38-4)14-18(21)27(28)17-11-12-23(36-2)24(13-17)37-3/h7-15H,6,16H2,1-5H3,(H,32,33)