1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[2-(4-tert-butyl-2,6-dimethylphenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[2-(4-tert-butyl-2,6-dimethyl-phenyl)ethyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C21H36N3OS+ MolecularWeight: 378.59504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CCNC(=S)NCC[NH+]2CCOCC2)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CCNC(=S)NCC[NH+]2CCOCC2)C)C(C)(C)C

InChI

InChI=1S/C21H35N3OS/c1-16-14-18(21(3,4)5)15-17(2)19(16)6-7-22-20(26)23-8-9-24-10-12-25-13-11-24/h14-15H,6-13H2,1-5H3,(H2,22,23,26)/p+1