2-(2,5-dimethoxyphenyl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethoxyphenyl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethoxyphenyl)sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethoxyphenyl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]nicotinamide Formula: C22H23N3O5S2 MolecularWeight: 473.56512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)SC2=C(C=CC=N2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)SC2=C(C=CC=N2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H23N3O5S2/c1-29-16-7-10-19(30-2)20(14-16)31-22-18(4-3-12-25-22)21(26)24-13-11-15-5-8-17(9-6-15)32(23,27)28/h3-10,12,14H,11,13H2,1-2H3,(H,24,26)(H2,23,27,28)