(2R)-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: (2R)-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: (2R)-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: (2R)-N-[5-(diethylsulfamoyl)-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: (2R)-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: (2R)-N-[5-(diethylsulfamoyl)-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]coumaran-2-carboxamide Formula: C25H35N4O4S+ MolecularWeight: 487.6348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)NC(=O)[C@H]3CC4=CC=CC=C4O3

InChI

InChI=1S/C25H34N4O4S/c1-4-27-13-15-28(16-14-27)22-12-11-20(34(31,32)29(5-2)6-3)18-21(22)26-25(30)24-17-19-9-7-8-10-23(19)33-24/h7-12,18,24H,4-6,13-17H2,1-3H3,(H,26,30)/p+1/t24-/m1/s1