ethyl 5,6-dimethoxy-3-(3,4,5-trimethoxyphenyl)sulfanyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 5,6-dimethoxy-3-(3,4,5-trimethoxyphenyl)sulfanyl-1H-indole-2-carboxylate Openeye Name: ethyl 5,6-dimethoxy-3-(3,4,5-trimethoxyphenyl)sulfanyl-1H-indole-2-carboxylate CAS Name: 5,6-dimethoxy-3-[(3,4,5-trimethoxyphenyl)thio]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-dimethoxy-3-(3,4,5-trimethoxyphenyl)sulfanyl-1H-indole-2-carboxylate Traditional Name: 5,6-dimethoxy-3-[(3,4,5-trimethoxyphenyl)thio]-1H-indole-2-carboxylic acid ethyl ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)SC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)SC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H25NO7S/c1-7-30-22(24)19-21(13-10-15(25-2)16(26-3)11-14(13)23-19)31-12-8-17(27-4)20(29-6)18(9-12)28-5/h8-11,23H,7H2,1-6H3