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

Systemtic Name: (4-phenylphenyl)methyl N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioate Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(4-phenylphenyl)methyl]isothiourea CAS Name: N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl N'-[2-(3,4-dimethoxyphenyl)ethyl]carbamimidothioate Traditional Name: 3-homoveratryl-2-(4-phenylbenzyl)isothiourea Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN=C(N)SCC2=CC=C(C=C2)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN=C(N)SCC2=CC=C(C=C2)C3=CC=CC=C3)OC

InChI

InChI=1S/C24H26N2O2S/c1-27-22-13-10-18(16-23(22)28-2)14-15-26-24(25)29-17-19-8-11-21(12-9-19)20-6-4-3-5-7-20/h3-13,16H,14-15,17H2,1-2H3,(H2,25,26)