(2S)-2-acetamido-3-(2-methylquinolin-4-yl)sulfanyl-propanoate

Systemtic Name: (2S)-2-acetamido-3-(2-methylquinolin-4-yl)sulfanyl-propanoate Openeye Name: (2S)-2-acetamido-3-[(2-methyl-4-quinolyl)sulfanyl]propanoate CAS Name: (2S)-2-acetamido-3-[(2-methyl-4-quinolinyl)thio]propanoate IUPAC Name: (2S)-2-acetamido-3-(2-methylquinolin-4-yl)sulfanylpropanoate Traditional Name: (2S)-2-acetamido-3-[(2-methyl-4-quinolyl)thio]propionate Formula: C15H15N2O3S- MolecularWeight: 303.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)SCC(C(=O)[O-])NC(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)SC[C@H](C(=O)[O-])NC(=O)C

InChI

InChI=1S/C15H16N2O3S/c1-9-7-14(11-5-3-4-6-12(11)16-9)21-8-13(15(19)20)17-10(2)18/h3-7,13H,8H2,1-2H3,(H,17,18)(H,19,20)/p-1/t13-/m1/s1