1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Openeye Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea CAS Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]thiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]thiourea Formula: C19H27N4O3S2+ MolecularWeight: 423.57268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCC(C2=CC=CO2)[NH+]3CCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NC[C@H](C2=CC=CO2)[NH+]3CCCC3

InChI

InChI=1S/C19H26N4O3S2/c1-22(2)28(24,25)16-8-5-7-15(13-16)21-19(27)20-14-17(18-9-6-12-26-18)23-10-3-4-11-23/h5-9,12-13,17H,3-4,10-11,14H2,1-2H3,(H2,20,21,27)/p+1/t17-/m1/s1