3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)thiourea Openeye Name: 3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)thiourea CAS Name: 3-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-methyl-1-(1-methyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 3-[5-(dimethylsulfamoyl)-2-methylphenyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)thiourea Traditional Name: 3-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)thiourea Formula: C17H29N4O2S2+ MolecularWeight: 385.56776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=S)N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C17H28N4O2S2/c1-13-6-7-15(25(22,23)19(2)3)12-16(13)18-17(24)21(5)14-8-10-20(4)11-9-14/h6-7,12,14H,8-11H2,1-5H3,(H,18,24)/p+1