(2-methylphenyl)methyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate

Systemtic Name: (2-methylphenyl)methyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-(o-tolylmethyl)isothiourea CAS Name: N'-(3-chloro-4-fluorophenyl)carbamimidothioic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl N'-(3-chloro-4-fluorophenyl)carbamimidothioate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-(2-methylbenzyl)isothiourea Formula: C15H14ClFN2S MolecularWeight: 308.801463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC(=NC2=CC(=C(C=C2)F)Cl)N

Isomeric SMILES

CC1=CC=CC=C1CSC(=NC2=CC(=C(C=C2)F)Cl)N

InChI

InChI=1S/C15H14ClFN2S/c1-10-4-2-3-5-11(10)9-20-15(18)19-12-6-7-14(17)13(16)8-12/h2-8H,9H2,1H3,(H2,18,19)