2-[4-(methylcarbamothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(methylcarbamothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(methylcarbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[methylamino(sulfanylidene)methyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(methylcarbamothioylamino)phenyl]acetic acid Traditional Name: 2-[4-(methylthiocarbamoylamino)phenyl]acetic acid Formula: C10H12N2O2S MolecularWeight: 224.27948

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C10H12N2O2S/c1-11-10(15)12-8-4-2-7(3-5-8)6-9(13)14/h2-5H,6H2,1H3,(H,13,14)(H2,11,12,15)