ethyl 2-(2-azanyl-5-methyl-phenyl)-2-methylsulfanyl-ethanoate

Systemtic Name: ethyl 2-(2-azanyl-5-methyl-phenyl)-2-methylsulfanyl-ethanoate Openeye Name: ethyl 2-(2-amino-5-methyl-phenyl)-2-methylsulfanyl-acetate CAS Name: 2-(2-amino-5-methylphenyl)-2-(methylthio)acetic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-5-methylphenyl)-2-methylsulfanylacetate Traditional Name: 2-(2-amino-5-methyl-phenyl)-2-(methylthio)acetic acid ethyl ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(C=CC(=C1)C)N)SC

Isomeric SMILES

CCOC(=O)C(C1=C(C=CC(=C1)C)N)SC

InChI

InChI=1S/C12H17NO2S/c1-4-15-12(14)11(16-3)9-7-8(2)5-6-10(9)13/h5-7,11H,4,13H2,1-3H3