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

Systemtic Name: (3-methoxyphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Openeye Name: 2-[(3-methoxyphenyl)methyl]-3-[2-(trifluoromethyl)phenyl]isothiourea CAS Name: N'-[2-(trifluoromethyl)phenyl]carbamimidothioic acid (3-methoxyphenyl)methyl ester IUPAC Name: (3-methoxyphenyl)methyl N'-[2-(trifluoromethyl)phenyl]carbamimidothioate Traditional Name: 2-m-anisyl-3-[2-(trifluoromethyl)phenyl]isothiourea Formula: C16H15F3N2OS MolecularWeight: 340.36331

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC(=NC2=CC=CC=C2C(F)(F)F)N

Isomeric SMILES

COC1=CC=CC(=C1)CSC(=NC2=CC=CC=C2C(F)(F)F)N

InChI

InChI=1S/C16H15F3N2OS/c1-22-12-6-4-5-11(9-12)10-23-15(20)21-14-8-3-2-7-13(14)16(17,18)19/h2-9H,10H2,1H3,(H2,20,21)