2-[[6,8-bis(chloranyl)-2-methyl-quinolin-4-yl]carbothioyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[[6,8-bis(chloranyl)-2-methyl-quinolin-4-yl]carbothioyl-methyl-amino]ethanoic acid Openeye Name: 2-[(6,8-dichloro-2-methyl-quinoline-4-carbothioyl)-methyl-amino]acetic acid CAS Name: 2-[[(6,8-dichloro-2-methyl-4-quinolinyl)-sulfanylidenemethyl]-methylamino]acetic acid IUPAC Name: 2-[(6,8-dichloro-2-methylquinoline-4-carbothioyl)-methylamino]acetic acid Traditional Name: 2-[(6,8-dichloro-2-methyl-quinoline-4-carbothioyl)-methyl-amino]acetic acid Formula: C14H12Cl2N2O2S MolecularWeight: 343.22828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2C(=C1)C(=S)N(C)CC(=O)O)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C(C=C2C(=C1)C(=S)N(C)CC(=O)O)Cl)Cl

InChI

InChI=1S/C14H12Cl2N2O2S/c1-7-3-10(14(21)18(2)6-12(19)20)9-4-8(15)5-11(16)13(9)17-7/h3-5H,6H2,1-2H3,(H,19,20)