methyl 3-azanyl-2-methyl-4-methylsulfanyl-benzoate

Systemtic Name: methyl 3-azanyl-2-methyl-4-methylsulfanyl-benzoate Openeye Name: methyl 3-amino-2-methyl-4-methylsulfanyl-benzoate CAS Name: 3-amino-2-methyl-4-(methylthio)benzoic acid methyl ester IUPAC Name: methyl 3-amino-2-methyl-4-methylsulfanylbenzoate Traditional Name: 3-amino-2-methyl-4-(methylthio)benzoic acid methyl ester Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N)SC)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1N)SC)C(=O)OC

InChI

InChI=1S/C10H13NO2S/c1-6-7(10(12)13-2)4-5-8(14-3)9(6)11/h4-5H,11H2,1-3H3