(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 4-azanyl-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 4-amino-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-amino-3,5,6-trichloro-2-pyridinecarboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 4-amino-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-amino-3,5,6-trichloro-picolinic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C17H11Cl4N3O2S MolecularWeight: 463.16514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)Cl

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)COC(=O)C3=NC(=C(C(=C3Cl)N)Cl)Cl)Cl

InChI

InChI=1S/C17H11Cl4N3O2S/c1-27-9-3-2-7-4-8(15(20)23-10(7)5-9)6-26-17(25)14-11(18)13(22)12(19)16(21)24-14/h2-5H,6H2,1H3,(H2,22,24)