2-(6-methylquinolin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-methylquinolin-4-yl)sulfanylethanoic acid Openeye Name: 2-[(6-methyl-4-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(6-methyl-4-quinolinyl)thio]acetic acid IUPAC Name: 2-(6-methylquinolin-4-yl)sulfanylacetic acid Traditional Name: 2-[(6-methyl-4-quinolyl)thio]acetic acid Formula: C12H11NO2S MolecularWeight: 233.28624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CN=C2C=C1)SCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=CN=C2C=C1)SCC(=O)O

InChI

InChI=1S/C12H11NO2S/c1-8-2-3-10-9(6-8)11(4-5-13-10)16-7-12(14)15/h2-6H,7H2,1H3,(H,14,15)