2-(3-methylphenoxy)ethyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate

Systemtic Name: 2-(3-methylphenoxy)ethyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(3-methylphenoxy)ethyl]isothiourea CAS Name: N'-(3-chloro-4-fluorophenyl)carbamimidothioic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl N'-(3-chloro-4-fluorophenyl)carbamimidothioate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(3-methylphenoxy)ethyl]isothiourea Formula: C16H16ClFN2OS MolecularWeight: 338.827443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC(=NC2=CC(=C(C=C2)F)Cl)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC(=NC2=CC(=C(C=C2)F)Cl)N

InChI

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