(2-methylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate

Systemtic Name: (2-methylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Openeye Name: 2-(o-tolylmethyl)-3-[2-(trifluoromethyl)phenyl]isothiourea CAS Name: N'-[2-(trifluoromethyl)phenyl]carbamimidothioic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Traditional Name: 2-(2-methylbenzyl)-3-[2-(trifluoromethyl)phenyl]isothiourea Formula: C16H15F3N2S MolecularWeight: 324.36391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC(=NC2=CC=CC=C2C(F)(F)F)N

Isomeric SMILES

CC1=CC=CC=C1CSC(=NC2=CC=CC=C2C(F)(F)F)N

InChI

InChI=1S/C16H15F3N2S/c1-11-6-2-3-7-12(11)10-22-15(20)21-14-9-5-4-8-13(14)16(17,18)19/h2-9H,10H2,1H3,(H2,20,21)