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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NCCC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NCCC(=O)O

InChI

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