1-(2,5-dimethylphenyl)-3-(2-methyl-2-morpholin-4-ium-4-yl-propyl)thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(2-methyl-2-morpholin-4-ium-4-yl-propyl)thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-(2-methyl-2-morpholin-4-ium-4-yl-propyl)thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[2-methyl-2-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-(2-methyl-2-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(2,5-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=CC(=C(C=C1)C)NC(=S)NCC(C)(C)[NH+]2CCOCC2

Isomeric SMILES

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

InChI

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