methyl 2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-methyl-amino]ethanoate

Systemtic Name: methyl 2-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonyl-methyl-amino]ethanoate Openeye Name: methyl 2-[(2-chloro-5-methylsulfanyl-benzoyl)-methyl-amino]acetate CAS Name: 2-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[(2-chloro-5-methylsulfanylbenzoyl)-methylamino]acetate Traditional Name: 2-[[2-chloro-5-(methylthio)benzoyl]-methyl-amino]acetic acid methyl ester Formula: C12H14ClNO3S MolecularWeight: 287.76246

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C(=O)C1=C(C=CC(=C1)SC)Cl

Isomeric SMILES

CN(CC(=O)OC)C(=O)C1=C(C=CC(=C1)SC)Cl

InChI

InChI=1S/C12H14ClNO3S/c1-14(7-11(15)17-2)12(16)9-6-8(18-3)4-5-10(9)13/h4-6H,7H2,1-3H3