1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propylpiperidin-1-ium-4-yl)thiourea

Systemtic Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propylpiperidin-1-ium-4-yl)thiourea Openeye Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propylpiperidin-1-ium-4-yl)thiourea CAS Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propyl-4-piperidin-1-iumyl)thiourea IUPAC Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propylpiperidin-1-ium-4-yl)thiourea Traditional Name: 1-[3-(dimethylsulfamoyl)phenyl]-3-(1-propylpiperidin-1-ium-4-yl)thiourea Formula: C17H29N4O2S2+ MolecularWeight: 385.56776

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=S)NC2=CC(=CC=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C17H28N4O2S2/c1-4-10-21-11-8-14(9-12-21)18-17(24)19-15-6-5-7-16(13-15)25(22,23)20(2)3/h5-7,13-14H,4,8-12H2,1-3H3,(H2,18,19,24)/p+1