methyl 4-(2-azanyl-4-fluoranyl-phenyl)sulfanylbutanoate

Systemtic Name: methyl 4-(2-azanyl-4-fluoranyl-phenyl)sulfanylbutanoate Openeye Name: methyl 4-(2-amino-4-fluoro-phenyl)sulfanylbutanoate CAS Name: 4-[(2-amino-4-fluorophenyl)thio]butanoic acid methyl ester IUPAC Name: methyl 4-(2-amino-4-fluorophenyl)sulfanylbutanoate Traditional Name: 4-[(2-amino-4-fluoro-phenyl)thio]butyric acid methyl ester Formula: C11H14FNO2S MolecularWeight: 243.297763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCSC1=C(C=C(C=C1)F)N

Isomeric SMILES

COC(=O)CCCSC1=C(C=C(C=C1)F)N

InChI

InChI=1S/C11H14FNO2S/c1-15-11(14)3-2-6-16-10-5-4-8(12)7-9(10)13/h4-5,7H,2-3,6,13H2,1H3