2-[(8-methoxyquinolin-5-yl)carbothioyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(8-methoxyquinolin-5-yl)carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[(8-methoxyquinoline-5-carbothioyl)-methyl-amino]acetic acid CAS Name: 2-[[(8-methoxy-5-quinolinyl)-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[(8-methoxyquinoline-5-carbothioyl)-methylamino]acetic acid Traditional Name: 2-[(8-methoxyquinoline-5-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=C2C=CC=NC2=C(C=C1)OC

Isomeric SMILES

CN(CC(=O)O)C(=S)C1=C2C=CC=NC2=C(C=C1)OC

InChI

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