4-(diethylsulfamoyl)-1-methyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrole-2-carboxamide

Systemtic Name: 4-(diethylsulfamoyl)-1-methyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrole-2-carboxamide Openeye Name: 4-(diethylsulfamoyl)-1-methyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrole-2-carboxamide CAS Name: 4-(diethylsulfamoyl)-1-methyl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-2-pyrrolecarboxamide IUPAC Name: 4-(diethylsulfamoyl)-1-methyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrrole-2-carboxamide Traditional Name: 4-(diethylsulfamoyl)-1-methyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]pyrrole-2-carboxamide Formula: C22H33N4O3S+ MolecularWeight: 433.58742

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)NCC2=CC=CC=C2C[NH+]3CCCC3)C

InChI

InChI=1S/C22H32N4O3S/c1-4-26(5-2)30(28,29)20-14-21(24(3)17-20)22(27)23-15-18-10-6-7-11-19(18)16-25-12-8-9-13-25/h6-7,10-11,14,17H,4-5,8-9,12-13,15-16H2,1-3H3,(H,23,27)/p+1