1-[3-(diethylsulfamoyl)phenyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[3-(diethylsulfamoyl)phenyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[3-(diethylsulfamoyl)phenyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[3-(diethylsulfamoyl)phenyl]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[3-(diethylsulfamoyl)phenyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[3-(diethylsulfamoyl)phenyl]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C18H31N4O3S2+ MolecularWeight: 415.59374

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCC[NH+]2CCOCC2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NC(=S)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C18H30N4O3S2/c1-3-22(4-2)27(23,24)17-8-5-7-16(15-17)20-18(26)19-9-6-10-21-11-13-25-14-12-21/h5,7-8,15H,3-4,6,9-14H2,1-2H3,(H2,19,20,26)/p+1