1-(4,5-dimethoxy-2-methyl-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-(4,5-dimethoxy-2-methyl-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(4,5-dimethoxy-2-methyl-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(4,5-dimethoxy-2-methylphenyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(4,5-dimethoxy-2-methylphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(4,5-dimethoxy-2-methyl-phenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C17H28N3O3S+ MolecularWeight: 354.48752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=S)NCCC[NH+]2CCOCC2)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=S)NCCC[NH+]2CCOCC2)OC)OC

InChI

InChI=1S/C17H27N3O3S/c1-13-11-15(21-2)16(22-3)12-14(13)19-17(24)18-5-4-6-20-7-9-23-10-8-20/h11-12H,4-10H2,1-3H3,(H2,18,19,24)/p+1