1-[3-(2,4-dimethylphenyl)propyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea

Systemtic Name: 1-[3-(2,4-dimethylphenyl)propyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Openeye Name: 1-[3-(2,4-dimethylphenyl)propyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[3-(2,4-dimethylphenyl)propyl]-3-[2-(4-morpholin-4-iumyl)ethyl]thiourea IUPAC Name: 1-[3-(2,4-dimethylphenyl)propyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Traditional Name: 1-[3-(2,4-dimethylphenyl)propyl]-3-(2-morpholin-4-ium-4-ylethyl)thiourea Formula: C18H30N3OS+ MolecularWeight: 336.5153

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3OS/c1-15-5-6-17(16(2)14-15)4-3-7-19-18(23)20-8-9-21-10-12-22-13-11-21/h5-6,14H,3-4,7-13H2,1-2H3,(H2,19,20,23)/p+1