2-[methyl-[2-(2-methylphenyl)sulfanylethanoyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[2-(2-methylphenyl)sulfanylethanoyl]amino]ethanoic acid Openeye Name: 2-[methyl-[2-(o-tolylsulfanyl)acetyl]amino]acetic acid CAS Name: 2-[methyl-[2-[(2-methylphenyl)thio]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[methyl-[2-(2-methylphenyl)sulfanylacetyl]amino]acetic acid Traditional Name: 2-[methyl-[2-(o-tolylthio)acetyl]amino]acetic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N(C)CC(=O)O

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N(C)CC(=O)O

InChI

InChI=1S/C12H15NO3S/c1-9-5-3-4-6-10(9)17-8-11(14)13(2)7-12(15)16/h3-6H,7-8H2,1-2H3,(H,15,16)