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

Systemtic Name: methyl 2-(4-azanyl-2-fluoranyl-phenyl)sulfanylethanoate Openeye Name: methyl 2-(4-amino-2-fluoro-phenyl)sulfanylacetate CAS Name: 2-[(4-amino-2-fluorophenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(4-amino-2-fluorophenyl)sulfanylacetate Traditional Name: 2-[(4-amino-2-fluoro-phenyl)thio]acetic acid methyl ester Formula: C9H10FNO2S MolecularWeight: 215.244603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C(C=C1)N)F

Isomeric SMILES

COC(=O)CSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C9H10FNO2S/c1-13-9(12)5-14-8-3-2-6(11)4-7(8)10/h2-4H,5,11H2,1H3