(4-methylsulfanylphenyl)methyl N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioate

Systemtic Name: (4-methylsulfanylphenyl)methyl N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioate Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-methylsulfanylphenyl)methyl]isothiourea CAS Name: N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioate Traditional Name: 3-homoveratryl-2-[4-(methylthio)benzyl]isothiourea Formula: C19H24N2O2S2 MolecularWeight: 376.53606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN=C(N)SCC2=CC=C(C=C2)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN=C(N)SCC2=CC=C(C=C2)SC)OC

InChI

InChI=1S/C19H24N2O2S2/c1-22-17-9-6-14(12-18(17)23-2)10-11-21-19(20)25-13-15-4-7-16(24-3)8-5-15/h4-9,12H,10-11,13H2,1-3H3,(H2,20,21)