2-[(2-methoxyquinolin-4-yl)carbothioyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(2-methoxyquinolin-4-yl)carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2-methoxyquinoline-4-carbothioyl)-methyl-amino]acetic acid CAS Name: 2-[[(2-methoxy-4-quinolinyl)-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[(2-methoxyquinoline-4-carbothioyl)-methylamino]acetic acid Traditional Name: 2-[(2-methoxyquinoline-4-carbothioyl)-methyl-amino]acetic acid Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=S)C1=CC(=NC2=CC=CC=C21)OC

Isomeric SMILES

CN(CC(=O)O)C(=S)C1=CC(=NC2=CC=CC=C21)OC

InChI

InChI=1S/C14H14N2O3S/c1-16(8-13(17)18)14(20)10-7-12(19-2)15-11-6-4-3-5-9(10)11/h3-7H,8H2,1-2H3,(H,17,18)