1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-3-(4-propan-2-ylphenyl)thiourea

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-(4-isopropylphenyl)-1-(2-morpholin-4-ium-4-ylethyl)thiourea CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-[2-(4-morpholin-4-iumyl)ethyl]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-1-(2-morpholin-4-ium-4-ylethyl)-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-(2-morpholin-4-ium-4-ylethyl)-3-p-cumenyl-1-veratryl-thiourea Formula: C25H36N3O3S+ MolecularWeight: 458.63664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)N(CC[NH+]2CCOCC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)N(CC[NH+]2CCOCC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C25H35N3O3S/c1-19(2)21-6-8-22(9-7-21)26-25(32)28(12-11-27-13-15-31-16-14-27)18-20-5-10-23(29-3)24(17-20)30-4/h5-10,17,19H,11-16,18H2,1-4H3,(H,26,32)/p+1