1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-[5-(diethylsulfamoyl)-2-methylphenyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-[5-(diethylsulfamoyl)-2-methyl-phenyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)thiourea Formula: C21H37N4O2S2+ MolecularWeight: 441.67408

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NC2CC([NH2+]C(C2)(C)C)(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)NC2CC([NH2+]C(C2)(C)C)(C)C

InChI

InChI=1S/C21H36N4O2S2/c1-8-25(9-2)29(26,27)17-11-10-15(3)18(12-17)23-19(28)22-16-13-20(4,5)24-21(6,7)14-16/h10-12,16,24H,8-9,13-14H2,1-7H3,(H2,22,23,28)/p+1