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

Systemtic Name: (4-chlorophenyl) N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioate Openeye Name: 1-benzyl-2-(4-chlorophenyl)-1-[(4-hydroxyphenyl)methyl]-3-phenyl-isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N'-phenyl-N-(phenylmethyl)carbamimidothioic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) N-benzyl-N-[(4-hydroxyphenyl)methyl]-N'-phenylcarbamimidothioate Traditional Name: 1-benzyl-2-(4-chlorophenyl)-1-(4-hydroxybenzyl)-3-phenyl-isothiourea Formula: C27H23ClN2OS MolecularWeight: 459.00232

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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=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H23ClN2OS/c28-23-13-17-26(18-14-23)32-27(29-24-9-5-2-6-10-24)30(19-21-7-3-1-4-8-21)20-22-11-15-25(31)16-12-22/h1-18,31H,19-20H2