3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzofuran-2-carboxamide Openeye Name: 3-[(4-methylthiazol-2-yl)sulfanylmethyl]-N-[2-(4-sulfamoylphenyl)ethyl]benzofuran-2-carboxamide CAS Name: 3-[[(4-methyl-2-thiazolyl)thio]methyl]-N-[2-(4-sulfamoylphenyl)ethyl]-2-benzofurancarboxamide IUPAC Name: 3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-N-[2-(4-sulfamoylphenyl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[[(4-methylthiazol-2-yl)thio]methyl]-N-[2-(4-sulfamoylphenyl)ethyl]coumarilamide Formula: C22H21N3O4S3 MolecularWeight: 487.61484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H21N3O4S3/c1-14-12-30-22(25-14)31-13-18-17-4-2-3-5-19(17)29-20(18)21(26)24-11-10-15-6-8-16(9-7-15)32(23,27)28/h2-9,12H,10-11,13H2,1H3,(H,24,26)(H2,23,27,28)