butyl 2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanylpropanoate

Systemtic Name: butyl 2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanylpropanoate Openeye Name: butyl 2-(5-amino-2-chloro-4-fluoro-phenyl)sulfanylpropanoate CAS Name: 2-[(5-amino-2-chloro-4-fluorophenyl)thio]propanoic acid butyl ester IUPAC Name: butyl 2-(5-amino-2-chloro-4-fluorophenyl)sulfanylpropanoate Traditional Name: 2-[(5-amino-2-chloro-4-fluoro-phenyl)thio]propionic acid butyl ester Formula: C13H17ClFNO2S MolecularWeight: 305.795983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)SC1=C(C=C(C(=C1)N)F)Cl

Isomeric SMILES

CCCCOC(=O)C(C)SC1=C(C=C(C(=C1)N)F)Cl

InChI

InChI=1S/C13H17ClFNO2S/c1-3-4-5-18-13(17)8(2)19-12-7-11(16)10(15)6-9(12)14/h6-8H,3-5,16H2,1-2H3