2-[(3-methylphenyl)carbamoylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[(3-methylphenyl)carbamoylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-(m-tolylcarbamoylamino)-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[(3-methylanilino)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(3-methylphenyl)carbamoylamino]-3-sulfanylpropanoic acid Traditional Name: 3-mercapto-2-(m-tolylcarbamoylamino)propionic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC(CS)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC(CS)C(=O)O

InChI

InChI=1S/C11H14N2O3S/c1-7-3-2-4-8(5-7)12-11(16)13-9(6-17)10(14)15/h2-5,9,17H,6H2,1H3,(H,14,15)(H2,12,13,16)