methyl N-[(4-hydroxyphenyl)methyl]-N-[2-(4-methoxyphenyl)ethyl]-N'-phenyl-carbamimidothioate

Systemtic Name: methyl N-[(4-hydroxyphenyl)methyl]-N-[2-(4-methoxyphenyl)ethyl]-N'-phenyl-carbamimidothioate Openeye Name: 1-[(4-hydroxyphenyl)methyl]-1-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenyl-isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N-[2-(4-methoxyphenyl)ethyl]-N'-phenylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[(4-hydroxyphenyl)methyl]-N-[2-(4-methoxyphenyl)ethyl]-N'-phenylcarbamimidothioate Traditional Name: 1-(4-hydroxybenzyl)-1-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-phenyl-isothiourea Formula: C24H26N2O2S MolecularWeight: 406.54044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN(CC2=CC=C(C=C2)O)C(=NC3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)CCN(CC2=CC=C(C=C2)O)C(=NC3=CC=CC=C3)SC

InChI

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