methyl N-[4-[4-[(C-methylsulfanyl-N-phenethyl-carbonimidoyl)amino]phenoxy]phenyl]-N'-phenethyl-carbamimidothioate

Systemtic Name: methyl N-[4-[4-[(C-methylsulfanyl-N-phenethyl-carbonimidoyl)amino]phenoxy]phenyl]-N'-phenethyl-carbamimidothioate Openeye Name: 2-methyl-1-[4-[4-[(C-methylsulfanyl-N-phenethyl-carbonimidoyl)amino]phenoxy]phenyl]-3-phenethyl-isothiourea CAS Name: N-[4-[4-[[(methylthio)-phenethyliminomethyl]amino]phenoxy]phenyl]-N'-phenethylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[4-[4-[(C-methylsulfanyl-N-phenethylcarbonimidoyl)amino]phenoxy]phenyl]-N'-phenethylcarbamimidothioate Traditional Name: 2-methyl-1-[4-[4-[[C-(methylthio)-N-phenethyl-carbonimidoyl]amino]phenoxy]phenyl]-3-phenethyl-isothiourea Formula: C32H34N4OS2 MolecularWeight: 554.76856

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NCCC1=CC=CC=C1)NC2=CC=C(C=C2)OC3=CC=C(C=C3)NC(=NCCC4=CC=CC=C4)SC

Isomeric SMILES

CSC(=NCCC1=CC=CC=C1)NC2=CC=C(C=C2)OC3=CC=C(C=C3)NC(=NCCC4=CC=CC=C4)SC

InChI

InChI=1S/C32H34N4OS2/c1-38-31(33-23-21-25-9-5-3-6-10-25)35-27-13-17-29(18-14-27)37-30-19-15-28(16-20-30)36-32(39-2)34-24-22-26-11-7-4-8-12-26/h3-20H,21-24H2,1-2H3,(H,33,35)(H,34,36)