ethyl 1-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-5-cyano-2-methyl-6-sulfanylidene-pyridine-3-carboxylate

Systemtic Name: ethyl 1-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]methyl]-5-cyano-2-methyl-6-sulfanylidene-pyridine-3-carboxylate Openeye Name: ethyl 1-[[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]methyl]-5-cyano-2-methyl-6-thioxo-pyridine-3-carboxylate CAS Name: 1-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-5-cyano-2-methyl-6-sulfanylidene-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-5-cyano-2-methyl-6-sulfanylidenepyridine-3-carboxylate Traditional Name: 1-[[(2-chloro-6-fluoro-benzyl)-methyl-amino]methyl]-5-cyano-2-methyl-6-thioxo-nicotinic acid ethyl ester Formula: C19H19ClFN3O2S MolecularWeight: 407.889463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)C(=C1)C#N)CN(C)CC2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)C(=C1)C#N)CN(C)CC2=C(C=CC=C2Cl)F)C

InChI

InChI=1S/C19H19ClFN3O2S/c1-4-26-19(25)14-8-13(9-22)18(27)24(12(14)2)11-23(3)10-15-16(20)6-5-7-17(15)21/h5-8H,4,10-11H2,1-3H3