1-(3,5-dimethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-(3,5-dimethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(3,5-dimethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(3,5-dimethoxyphenyl)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(3,5-dimethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(3,5-dimethoxyphenyl)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C16H26N3O3S+ MolecularWeight: 340.46094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=S)NCCC[NH+]2CCOCC2)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=S)NCCC[NH+]2CCOCC2)OC

InChI

InChI=1S/C16H25N3O3S/c1-20-14-10-13(11-15(12-14)21-2)18-16(23)17-4-3-5-19-6-8-22-9-7-19/h10-12H,3-9H2,1-2H3,(H2,17,18,23)/p+1