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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)SC1=C(C=C(C(=C1)N)F)Cl

Isomeric SMILES

CC(C(=O)OC(C)(C)C)SC1=C(C=C(C(=C1)N)F)Cl

InChI

InChI=1S/C13H17ClFNO2S/c1-7(12(17)18-13(2,3)4)19-11-6-10(16)9(15)5-8(11)14/h5-7H,16H2,1-4H3