2-[3-(dimethylcarbamoylamino)sulfanylphenyl]ethanoic acid

Systemtic Name: 2-[3-(dimethylcarbamoylamino)sulfanylphenyl]ethanoic acid Openeye Name: 2-[3-(dimethylcarbamoylamino)sulfanylphenyl]acetic acid CAS Name: 2-[3-[[[dimethylamino(oxo)methyl]amino]thio]phenyl]acetic acid IUPAC Name: 2-[3-(dimethylcarbamoylamino)sulfanylphenyl]acetic acid Traditional Name: 2-[3-[(dimethylcarbamoylamino)thio]phenyl]acetic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NSC1=CC=CC(=C1)CC(=O)O

Isomeric SMILES

CN(C)C(=O)NSC1=CC=CC(=C1)CC(=O)O

InChI

InChI=1S/C11H14N2O3S/c1-13(2)11(16)12-17-9-5-3-4-8(6-9)7-10(14)15/h3-6H,7H2,1-2H3,(H,12,16)(H,14,15)