1-(3-morpholin-4-ium-4-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea

Systemtic Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea Openeye Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-(2,4,6-trimethylphenyl)thiourea IUPAC Name: 1-(3-morpholin-4-ium-4-ylpropyl)-3-(2,4,6-trimethylphenyl)thiourea Traditional Name: 1-mesityl-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C17H28N3OS+ MolecularWeight: 322.48872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=S)NCCC[NH+]2CCOCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=S)NCCC[NH+]2CCOCC2)C

InChI

InChI=1S/C17H27N3OS/c1-13-11-14(2)16(15(3)12-13)19-17(22)18-5-4-6-20-7-9-21-10-8-20/h11-12H,4-10H2,1-3H3,(H2,18,19,22)/p+1