1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea

Systemtic Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Openeye Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea CAS Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]thiourea IUPAC Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Traditional Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]thiourea Formula: C19H33N4O2S2+ MolecularWeight: 413.62092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O2S2/c1-5-22-12-8-9-16(22)14-20-19(26)21-18-13-17(11-10-15(18)4)27(24,25)23(6-2)7-3/h10-11,13,16H,5-9,12,14H2,1-4H3,(H2,20,21,26)/p+1/t16-/m0/s1