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

Systemtic Name: 2-(4-ethoxyphenoxy)ethyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(4-ethoxyphenoxy)ethyl]isothiourea CAS Name: N'-(3-chloro-4-fluorophenyl)carbamimidothioic acid 2-(4-ethoxyphenoxy)ethyl ester IUPAC Name: 2-(4-ethoxyphenoxy)ethyl N'-(3-chloro-4-fluorophenyl)carbamimidothioate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-[2-(4-ethoxyphenoxy)ethyl]isothiourea Formula: C17H18ClFN2O2S MolecularWeight: 368.853423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC(=NC2=CC(=C(C=C2)F)Cl)N

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC(=NC2=CC(=C(C=C2)F)Cl)N

InChI

InChI=1S/C17H18ClFN2O2S/c1-2-22-13-4-6-14(7-5-13)23-9-10-24-17(20)21-12-3-8-16(19)15(18)11-12/h3-8,11H,2,9-10H2,1H3,(H2,20,21)