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

Systemtic Name: pentyl 2-(5-azanyl-2-chloranyl-4-fluoranyl-phenyl)sulfanylethanoate Openeye Name: pentyl 2-(5-amino-2-chloro-4-fluoro-phenyl)sulfanylacetate CAS Name: 2-[(5-amino-2-chloro-4-fluorophenyl)thio]acetic acid pentyl ester IUPAC Name: pentyl 2-(5-amino-2-chloro-4-fluorophenyl)sulfanylacetate Traditional Name: 2-[(5-amino-2-chloro-4-fluoro-phenyl)thio]acetic acid amyl ester Formula: C13H17ClFNO2S MolecularWeight: 305.795983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CSC1=C(C=C(C(=C1)N)F)Cl

Isomeric SMILES

CCCCCOC(=O)CSC1=C(C=C(C(=C1)N)F)Cl

InChI

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