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

Systemtic Name: pentyl 2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanylpropanoate Openeye Name: pentyl 2-(5-amino-2-chloro-4-fluoro-phenyl)sulfanylpropanoate CAS Name: 2-[(5-amino-2-chloro-4-fluorophenyl)thio]propanoic acid pentyl ester IUPAC Name: pentyl 2-(5-amino-2-chloro-4-fluorophenyl)sulfanylpropanoate Traditional Name: 2-[(5-amino-2-chloro-4-fluoro-phenyl)thio]propionic acid amyl ester Formula: C14H19ClFNO2S MolecularWeight: 319.822563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClFNO2S/c1-3-4-5-6-19-14(18)9(2)20-13-8-12(17)11(16)7-10(13)15/h7-9H,3-6,17H2,1-2H3