(4-methylphenyl) N-(2,2-diphenylethyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate

Systemtic Name: (4-methylphenyl) N-(2,2-diphenylethyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Openeye Name: 1-(2,2-diphenylethyl)-1-[(4-hydroxyphenyl)methyl]-2-(p-tolyl)isothiourea CAS Name: N-(2,2-diphenylethyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) N-(2,2-diphenylethyl)-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Traditional Name: 1-(2,2-diphenylethyl)-1-(4-hydroxybenzyl)-2-(p-tolyl)isothiourea Formula: C29H28N2OS MolecularWeight: 452.61042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=N)N(CC2=CC=C(C=C2)O)CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC(=N)N(CC2=CC=C(C=C2)O)CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H28N2OS/c1-22-12-18-27(19-13-22)33-29(30)31(20-23-14-16-26(32)17-15-23)21-28(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-19,28,30,32H,20-21H2,1H3