2-[(2-methyl-3-sulfanyl-propanoyl)amino]-3-pyridin-2-yl-propanoic acid

Systemtic Name: 2-[(2-methyl-3-sulfanyl-propanoyl)amino]-3-pyridin-2-yl-propanoic acid Openeye Name: 2-[(2-methyl-3-sulfanyl-propanoyl)amino]-3-(2-pyridyl)propanoic acid CAS Name: 2-[(3-mercapto-2-methyl-1-oxopropyl)amino]-3-(2-pyridinyl)propanoic acid IUPAC Name: 2-[(2-methyl-3-sulfanylpropanoyl)amino]-3-pyridin-2-ylpropanoic acid Traditional Name: 2-[(3-mercapto-2-methyl-propanoyl)amino]-3-(2-pyridyl)propionic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)NC(CC1=CC=CC=N1)C(=O)O

Isomeric SMILES

CC(CS)C(=O)NC(CC1=CC=CC=N1)C(=O)O

InChI

InChI=1S/C12H16N2O3S/c1-8(7-18)11(15)14-10(12(16)17)6-9-4-2-3-5-13-9/h2-5,8,10,18H,6-7H2,1H3,(H,14,15)(H,16,17)