ethyl 6-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylthio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylsulfanyl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylthio]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C21H19ClN4O2S MolecularWeight: 426.91916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C

InChI

InChI=1S/C21H19ClN4O2S/c1-4-28-21(27)17-10-15(11-23)20(24-13(17)2)29-12-18-14(3)25-26(19(18)22)16-8-6-5-7-9-16/h5-10H,4,12H2,1-3H3