methyl 4-azanyl-3-methyl-5-(methylsulfanylmethyl)benzoate

Systemtic Name: methyl 4-azanyl-3-methyl-5-(methylsulfanylmethyl)benzoate Openeye Name: methyl 4-amino-3-methyl-5-(methylsulfanylmethyl)benzoate CAS Name: 4-amino-3-methyl-5-[(methylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-methyl-5-(methylsulfanylmethyl)benzoate Traditional Name: 4-amino-3-methyl-5-[(methylthio)methyl]benzoic acid methyl ester Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)OC)CSC)N

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)OC)CSC)N

InChI

InChI=1S/C11H15NO2S/c1-7-4-8(11(13)14-2)5-9(6-15-3)10(7)12/h4-5H,6,12H2,1-3H3