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

Systemtic Name: (4-methylphenyl) N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioate Openeye Name: 1-benzyl-1-[(4-hydroxyphenyl)methyl]-3-phenyl-2-(p-tolyl)isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) N-benzyl-N-[(4-hydroxyphenyl)methyl]-N'-phenylcarbamimidothioate Traditional Name: 1-benzyl-1-(4-hydroxybenzyl)-3-phenyl-2-(p-tolyl)isothiourea Formula: C28H26N2OS MolecularWeight: 438.58384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=NC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=C(C=C4)O

Isomeric SMILES

CC1=CC=C(C=C1)SC(=NC2=CC=CC=C2)N(CC3=CC=CC=C3)CC4=CC=C(C=C4)O

InChI

InChI=1S/C28H26N2OS/c1-22-12-18-27(19-13-22)32-28(29-25-10-6-3-7-11-25)30(20-23-8-4-2-5-9-23)21-24-14-16-26(31)17-15-24/h2-19,31H,20-21H2,1H3