1-(2,6-dimethylphenyl)-3-(2-methyl-2-morpholin-4-ium-4-yl-propyl)thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3OS/c1-13-6-5-7-14(2)15(13)19-16(22)18-12-17(3,4)20-8-10-21-11-9-20/h5-7H,8-12H2,1-4H3,(H2,18,19,22)/p+1