2-(1-ethyl-5-methoxy-indol-3-yl)-1-(4-methylphenyl)sulfonyl-pyrrolo[2,3-b]pyridine-4-carboxylic acid

Systemtic Name: 2-(1-ethyl-5-methoxy-indol-3-yl)-1-(4-methylphenyl)sulfonyl-pyrrolo[2,3-b]pyridine-4-carboxylic acid Openeye Name: 2-(1-ethyl-5-methoxy-indol-3-yl)-1-(p-tolylsulfonyl)pyrrolo[2,3-b]pyridine-4-carboxylic acid CAS Name: 2-(1-ethyl-5-methoxy-3-indolyl)-1-(4-methylphenyl)sulfonyl-4-pyrrolo[2,3-b]pyridinecarboxylic acid IUPAC Name: 2-(1-ethyl-5-methoxyindol-3-yl)-1-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridine-4-carboxylic acid Traditional Name: 2-(1-ethyl-5-methoxy-indol-3-yl)-1-tosyl-pyrrolo[2,3-b]pyridine-4-carboxylic acid Formula: C26H23N3O5S MolecularWeight: 489.54292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(C=CN=C4N3S(=O)(=O)C5=CC=C(C=C5)C)C(=O)O

Isomeric SMILES

CCN1C=C(C2=C1C=CC(=C2)OC)C3=CC4=C(C=CN=C4N3S(=O)(=O)C5=CC=C(C=C5)C)C(=O)O

InChI

InChI=1S/C26H23N3O5S/c1-4-28-15-22(20-13-17(34-3)7-10-23(20)28)24-14-21-19(26(30)31)11-12-27-25(21)29(24)35(32,33)18-8-5-16(2)6-9-18/h5-15H,4H2,1-3H3,(H,30,31)