methyl N'-[4-[4-[(Z)-2-methylsulfanyl-2-phenylazanyl-ethenyl]phenoxy]phenyl]-N-phenyl-carbamimidothioate

Systemtic Name: methyl N'-[4-[4-[(Z)-2-methylsulfanyl-2-phenylazanyl-ethenyl]phenoxy]phenyl]-N-phenyl-carbamimidothioate Openeye Name: 3-[4-[4-[(Z)-2-anilino-2-methylsulfanyl-vinyl]phenoxy]phenyl]-2-methyl-1-phenyl-isothiourea CAS Name: N'-[4-[4-[(Z)-2-anilino-2-(methylthio)ethenyl]phenoxy]phenyl]-N-phenylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[4-[4-[(Z)-2-anilino-2-methylsulfanylethenyl]phenoxy]phenyl]-N-phenylcarbamimidothioate Traditional Name: 3-[4-[4-[(Z)-2-anilino-2-(methylthio)vinyl]phenoxy]phenyl]-2-methyl-1-phenyl-isothiourea Formula: C29H27N3OS2 MolecularWeight: 497.67418

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC1=CC=C(C=C1)OC2=CC=C(C=C2)N=C(NC3=CC=CC=C3)SC)NC4=CC=CC=C4

Isomeric SMILES

CS/C(=C\C1=CC=C(C=C1)OC2=CC=C(C=C2)N=C(NC3=CC=CC=C3)SC)/NC4=CC=CC=C4

InChI

InChI=1S/C29H27N3OS2/c1-34-28(30-23-9-5-3-6-10-23)21-22-13-17-26(18-14-22)33-27-19-15-25(16-20-27)32-29(35-2)31-24-11-7-4-8-12-24/h3-21,30H,1-2H3,(H,31,32)/b28-21-