1-(5-tert-butyl-2-methoxy-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C18H30N3O2S+ MolecularWeight: 352.5147

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O2S/c1-18(2,3)14-5-6-16(22-4)15(13-14)20-17(24)19-7-8-21-9-11-23-12-10-21/h5-6,13H,7-12H2,1-4H3,(H2,19,20,24)/p+1