1-[(2,5-dimethoxyphenyl)methyl]-3-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(2,5-dimethoxyphenyl)methyl]-1-(3-morpholin-4-ium-4-ylpropyl)-3-(p-tolyl)thiourea CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-(4-methylphenyl)-1-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(2,5-dimethoxyphenyl)methyl]-3-(4-methylphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-(2,5-dimethoxybenzyl)-1-(3-morpholin-4-ium-4-ylpropyl)-3-(p-tolyl)thiourea Formula: C24H34N3O3S+ MolecularWeight: 444.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N(CCC[NH+]2CCOCC2)CC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N(CCC[NH+]2CCOCC2)CC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C24H33N3O3S/c1-19-5-7-21(8-6-19)25-24(31)27(12-4-11-26-13-15-30-16-14-26)18-20-17-22(28-2)9-10-23(20)29-3/h5-10,17H,4,11-16,18H2,1-3H3,(H,25,31)/p+1