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

Systemtic Name: ethyl N'-(3-chloranyl-4-fluoranyl-phenyl)carbamimidothioate Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-2-ethyl-isothiourea CAS Name: N'-(3-chloro-4-fluorophenyl)carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-(3-chloro-4-fluorophenyl)carbamimidothioate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-2-ethyl-isothiourea Formula: C9H10ClFN2S MolecularWeight: 232.705503

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=CC(=C(C=C1)F)Cl)N

Isomeric SMILES

CCSC(=NC1=CC(=C(C=C1)F)Cl)N

InChI

InChI=1S/C9H10ClFN2S/c1-2-14-9(12)13-6-3-4-8(11)7(10)5-6/h3-5H,2H2,1H3,(H2,12,13)