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

Systemtic Name: methyl N-[(4-hydroxyphenyl)methyl]-N-phenethyl-N'-(phenylcarbonyl)carbamimidothioate Openeye Name: N-[[(4-hydroxyphenyl)methyl-phenethyl-amino]-methylsulfanyl-methylene]benzamide CAS Name: N'-benzoyl-N-[(4-hydroxyphenyl)methyl]-N-phenethylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-benzoyl-N-[(4-hydroxyphenyl)methyl]-N-phenethylcarbamimidothioate Traditional Name: N-[[(4-hydroxybenzyl)-phenethyl-amino]-(methylthio)methylene]benzamide Formula: C24H24N2O2S MolecularWeight: 404.52456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC(=O)C1=CC=CC=C1)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)O

Isomeric SMILES

CSC(=NC(=O)C1=CC=CC=C1)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)O

InChI

InChI=1S/C24H24N2O2S/c1-29-24(25-23(28)21-10-6-3-7-11-21)26(17-16-19-8-4-2-5-9-19)18-20-12-14-22(27)15-13-20/h2-15,27H,16-18H2,1H3