2-[methyl-(2,4,6-trimethylphenyl)carbamoyl]sulfanylpropanoic acid

Systemtic Name: 2-[methyl-(2,4,6-trimethylphenyl)carbamoyl]sulfanylpropanoic acid Openeye Name: 2-[methyl-(2,4,6-trimethylphenyl)carbamoyl]sulfanylpropanoic acid CAS Name: 2-[[oxo-(N,2,4,6-tetramethylanilino)methyl]thio]propanoic acid IUPAC Name: 2-[methyl-(2,4,6-trimethylphenyl)carbamoyl]sulfanylpropanoic acid Traditional Name: 2-[[mesityl(methyl)carbamoyl]thio]propionic acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N(C)C(=O)SC(C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N(C)C(=O)SC(C)C(=O)O)C

InChI

InChI=1S/C14H19NO3S/c1-8-6-9(2)12(10(3)7-8)15(5)14(18)19-11(4)13(16)17/h6-7,11H,1-5H3,(H,16,17)