3-[(2-methylphenyl)carbamothioylamino]propanoic acid

Systemtic Name: 3-[(2-methylphenyl)carbamothioylamino]propanoic acid Openeye Name: 3-(o-tolylcarbamothioylamino)propanoic acid CAS Name: 3-[[(2-methylanilino)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[(2-methylphenyl)carbamothioylamino]propanoic acid Traditional Name: 3-(o-tolylthiocarbamoylamino)propionic acid Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NCCC(=O)O

InChI

InChI=1S/C11H14N2O2S/c1-8-4-2-3-5-9(8)13-11(16)12-7-6-10(14)15/h2-5H,6-7H2,1H3,(H,14,15)(H2,12,13,16)