ethyl 2-tert-butyl-3-chloranyl-6-(4-chlorophenyl)sulfanyl-5-cyano-pyridine-4-carboxylate

Systemtic Name: ethyl 2-tert-butyl-3-chloranyl-6-(4-chlorophenyl)sulfanyl-5-cyano-pyridine-4-carboxylate Openeye Name: ethyl 2-tert-butyl-3-chloro-6-(4-chlorophenyl)sulfanyl-5-cyano-pyridine-4-carboxylate CAS Name: 2-tert-butyl-3-chloro-6-[(4-chlorophenyl)thio]-5-cyano-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-tert-butyl-3-chloro-6-(4-chlorophenyl)sulfanyl-5-cyanopyridine-4-carboxylate Traditional Name: 2-tert-butyl-3-chloro-6-[(4-chlorophenyl)thio]-5-cyano-isonicotinic acid ethyl ester Formula: C19H18Cl2N2O2S MolecularWeight: 409.32942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NC(=C1Cl)C(C)(C)C)SC2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(C(=NC(=C1Cl)C(C)(C)C)SC2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C19H18Cl2N2O2S/c1-5-25-18(24)14-13(10-22)17(23-16(15(14)21)19(2,3)4)26-12-8-6-11(20)7-9-12/h6-9H,5H2,1-4H3