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

Systemtic Name: phenyl N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioate Openeye Name: 1-benzyl-1-[(4-hydroxyphenyl)methyl]-2,3-diphenyl-isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioic acid phenyl ester IUPAC Name: phenyl N-benzyl-N-[(4-hydroxyphenyl)methyl]-N'-phenylcarbamimidothioate Traditional Name: 1-benzyl-1-(4-hydroxybenzyl)-2,3-diphenyl-isothiourea Formula: C27H24N2OS MolecularWeight: 424.55726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)O)C(=NC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=C(C=C2)O)C(=NC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C27H24N2OS/c30-25-18-16-23(17-19-25)21-29(20-22-10-4-1-5-11-22)27(28-24-12-6-2-7-13-24)31-26-14-8-3-9-15-26/h1-19,30H,20-21H2