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

Systemtic Name: methyl 4-azanyl-3-chloranyl-5-(methylsulfanylmethyl)benzoate Openeye Name: methyl 4-amino-3-chloro-5-(methylsulfanylmethyl)benzoate CAS Name: 4-amino-3-chloro-5-[(methylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-chloro-5-(methylsulfanylmethyl)benzoate Traditional Name: 4-amino-3-chloro-5-[(methylthio)methyl]benzoic acid methyl ester Formula: C10H12ClNO2S MolecularWeight: 245.72578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)Cl)N)CSC

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)Cl)N)CSC

InChI

InChI=1S/C10H12ClNO2S/c1-14-10(13)6-3-7(5-15-2)9(12)8(11)4-6/h3-4H,5,12H2,1-2H3