2-(phenylsulfanylmethyl)-N-(1-pyrrolidin-2-ylpropyl)-5-sulfamoyl-2,3-dihydro-1-benzofuran-7-carboxamide

Systemtic Name: 2-(phenylsulfanylmethyl)-N-(1-pyrrolidin-2-ylpropyl)-5-sulfamoyl-2,3-dihydro-1-benzofuran-7-carboxamide Openeye Name: 2-(phenylsulfanylmethyl)-N-(1-pyrrolidin-2-ylpropyl)-5-sulfamoyl-2,3-dihydrobenzofuran-7-carboxamide CAS Name: 2-[(phenylthio)methyl]-N-[1-(2-pyrrolidinyl)propyl]-5-sulfamoyl-2,3-dihydrobenzofuran-7-carboxamide IUPAC Name: 2-(phenylsulfanylmethyl)-N-(1-pyrrolidin-2-ylpropyl)-5-sulfamoyl-2,3-dihydro-1-benzofuran-7-carboxamide Traditional Name: 2-[(phenylthio)methyl]-N-(1-pyrrolidin-2-ylpropyl)-5-sulfamoyl-coumaran-7-carboxamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1CCCN1)NC(=O)C2=CC(=CC3=C2OC(C3)CSC4=CC=CC=C4)S(=O)(=O)N

Isomeric SMILES

CCC(C1CCCN1)NC(=O)C2=CC(=CC3=C2OC(C3)CSC4=CC=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C23H29N3O4S2/c1-2-20(21-9-6-10-25-21)26-23(27)19-13-18(32(24,28)29)12-15-11-16(30-22(15)19)14-31-17-7-4-3-5-8-17/h3-5,7-8,12-13,16,20-21,25H,2,6,9-11,14H2,1H3,(H,26,27)(H2,24,28,29)