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

Systemtic Name: (4-chlorophenyl) N'-(4-chlorophenyl)-N-[(4-hydroxyphenyl)methyl]-N-phenethyl-carbamimidothioate Openeye Name: 2,3-bis(4-chlorophenyl)-1-[(4-hydroxyphenyl)methyl]-1-phenethyl-isothiourea CAS Name: N'-(4-chlorophenyl)-N-[(4-hydroxyphenyl)methyl]-N-phenethylcarbamimidothioic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) N'-(4-chlorophenyl)-N-[(4-hydroxyphenyl)methyl]-N-phenethylcarbamimidothioate Traditional Name: 2,3-bis(4-chlorophenyl)-1-(4-hydroxybenzyl)-1-phenethyl-isothiourea Formula: C28H24Cl2N2OS MolecularWeight: 507.47396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24Cl2N2OS/c29-23-8-12-25(13-9-23)31-28(34-27-16-10-24(30)11-17-27)32(19-18-21-4-2-1-3-5-21)20-22-6-14-26(33)15-7-22/h1-17,33H,18-20H2