(2-chloranyl-6-fluoranyl-phenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl]-3-[(2-methoxyphenyl)methyl]isothiourea CAS Name: N'-[(2-methoxyphenyl)methyl]carbamimidothioic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl N'-[(2-methoxyphenyl)methyl]carbamimidothioate Traditional Name: 2-(2-chloro-6-fluoro-benzyl)-3-o-anisyl-isothiourea Formula: C16H16ClFN2OS MolecularWeight: 338.827443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN=C(N)SCC2=C(C=CC=C2Cl)F

Isomeric SMILES

COC1=CC=CC=C1CN=C(N)SCC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C16H16ClFN2OS/c1-21-15-8-3-2-5-11(15)9-20-16(19)22-10-12-13(17)6-4-7-14(12)18/h2-8H,9-10H2,1H3,(H2,19,20)