3-[(phenylmethylsulfanyl)methyl]-N-[(4-sulfamoylphenyl)methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-[(phenylmethylsulfanyl)methyl]-N-[(4-sulfamoylphenyl)methyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(benzylsulfanylmethyl)-N-[(4-sulfamoylphenyl)methyl]benzofuran-2-carboxamide CAS Name: 3-[(phenylmethylthio)methyl]-N-[(4-sulfamoylphenyl)methyl]-2-benzofurancarboxamide IUPAC Name: 3-(benzylsulfanylmethyl)-N-[(4-sulfamoylphenyl)methyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(benzylthio)methyl]-N-(4-sulfamoylbenzyl)coumarilamide Formula: C24H22N2O4S2 MolecularWeight: 466.57248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CSCC2=C(OC3=CC=CC=C32)C(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C24H22N2O4S2/c25-32(28,29)19-12-10-17(11-13-19)14-26-24(27)23-21(20-8-4-5-9-22(20)30-23)16-31-15-18-6-2-1-3-7-18/h1-13H,14-16H2,(H,26,27)(H2,25,28,29)