(4-methylphenyl) N'-[2-(1-benzothiophen-3-yl)ethanoyl]-N-[(4-hydroxyphenyl)methyl]-N-(phenylmethyl)carbamimidothioate

Systemtic Name: (4-methylphenyl) N'-[2-(1-benzothiophen-3-yl)ethanoyl]-N-[(4-hydroxyphenyl)methyl]-N-(phenylmethyl)carbamimidothioate Openeye Name: 2-(benzothiophen-3-yl)-N-[[benzyl-[(4-hydroxyphenyl)methyl]amino]-(p-tolylsulfanyl)methylene]acetamide CAS Name: N'-[2-(1-benzothiophen-3-yl)-1-oxoethyl]-N-[(4-hydroxyphenyl)methyl]-N-(phenylmethyl)carbamimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) N'-[2-(1-benzothiophen-3-yl)acetyl]-N-benzyl-N-[(4-hydroxyphenyl)methyl]carbamimidothioate Traditional Name: 2-(benzothiophen-3-yl)-N-[[benzyl-(4-hydroxybenzyl)amino]-(p-tolylthio)methylene]acetamide Formula: C32H28N2O2S2 MolecularWeight: 536.70692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=NC(=O)CC2=CSC3=CC=CC=C32)N(CC4=CC=CC=C4)CC5=CC=C(C=C5)O

Isomeric SMILES

CC1=CC=C(C=C1)SC(=NC(=O)CC2=CSC3=CC=CC=C32)N(CC4=CC=CC=C4)CC5=CC=C(C=C5)O

InChI

InChI=1S/C32H28N2O2S2/c1-23-11-17-28(18-12-23)38-32(33-31(36)19-26-22-37-30-10-6-5-9-29(26)30)34(20-24-7-3-2-4-8-24)21-25-13-15-27(35)16-14-25/h2-18,22,35H,19-21H2,1H3