2-[(6-chloranyl-2-methyl-quinolin-4-yl)carbothioyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(6-chloranyl-2-methyl-quinolin-4-yl)carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[(6-chloro-2-methyl-quinoline-4-carbothioyl)-methyl-amino]acetic acid CAS Name: 2-[[(6-chloro-2-methyl-4-quinolinyl)-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[(6-chloro-2-methylquinoline-4-carbothioyl)-methylamino]acetic acid Traditional Name: 2-[(6-chloro-2-methyl-quinoline-4-carbothioyl)-methyl-amino]acetic acid Formula: C14H13ClN2O2S MolecularWeight: 308.78322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Cl)C(=C1)C(=S)N(C)CC(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Cl)C(=C1)C(=S)N(C)CC(=O)O

InChI

InChI=1S/C14H13ClN2O2S/c1-8-5-11(14(20)17(2)7-13(18)19)10-6-9(15)3-4-12(10)16-8/h3-6H,7H2,1-2H3,(H,18,19)