methyl N-[(4-hydroxyphenyl)methyl]-N-(4-methoxyphenyl)-N'-(phenylmethyl)carbamimidothioate

Systemtic Name: methyl N-[(4-hydroxyphenyl)methyl]-N-(4-methoxyphenyl)-N'-(phenylmethyl)carbamimidothioate Openeye Name: 3-benzyl-1-[(4-hydroxyphenyl)methyl]-1-(4-methoxyphenyl)-2-methyl-isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N-(4-methoxyphenyl)-N'-(phenylmethyl)carbamimidothioic acid methyl ester IUPAC Name: methyl N'-benzyl-N-[(4-hydroxyphenyl)methyl]-N-(4-methoxyphenyl)carbamimidothioate Traditional Name: 3-benzyl-1-(4-hydroxybenzyl)-1-(4-methoxyphenyl)-2-methyl-isothiourea Formula: C23H24N2O2S MolecularWeight: 392.51386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=C(C=C2)O)C(=NCC3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=C(C=C2)O)C(=NCC3=CC=CC=C3)SC

InChI

InChI=1S/C23H24N2O2S/c1-27-22-14-10-20(11-15-22)25(17-19-8-12-21(26)13-9-19)23(28-2)24-16-18-6-4-3-5-7-18/h3-15,26H,16-17H2,1-2H3