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

Systemtic Name: methyl 2-(2-azanyl-4-methylsulfonyl-phenyl)sulfanylethanoate Openeye Name: methyl 2-(2-amino-4-methylsulfonyl-phenyl)sulfanylacetate CAS Name: 2-[(2-amino-4-methylsulfonylphenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(2-amino-4-methylsulfonylphenyl)sulfanylacetate Traditional Name: 2-[(2-amino-4-mesyl-phenyl)thio]acetic acid methyl ester Formula: C10H13NO4S2 MolecularWeight: 275.34452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO4S2/c1-15-10(12)6-16-9-4-3-7(5-8(9)11)17(2,13)14/h3-5H,6,11H2,1-2H3