1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Formula: C16H27N4O2S2+ MolecularWeight: 371.54118

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CC[NH+]1CCC[C@@H]1CNC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C16H26N4O2S2/c1-4-20-10-6-8-14(20)12-17-16(23)18-13-7-5-9-15(11-13)24(21,22)19(2)3/h5,7,9,11,14H,4,6,8,10,12H2,1-3H3,(H2,17,18,23)/p+1/t14-/m1/s1