1-[(2,5-dimethylphenyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(2,5-dimethylphenyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-(2,5-dimethylanilino)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-(2,5-dimethylanilino)-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-(2,5-dimethylanilino)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(2,5-dimethylanilino)-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C16H27N4OS+ MolecularWeight: 323.47678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4OS/c1-13-4-5-14(2)15(12-13)18-19-16(22)17-6-3-7-20-8-10-21-11-9-20/h4-5,12,18H,3,6-11H2,1-2H3,(H2,17,19,22)/p+1