ethyl 4-ethyl-5-ethylsulfanylcarbonyl-6-(2-methoxyethyl)-2-phenyl-pyridine-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-ethylsulfanylcarbonyl-6-(2-methoxyethyl)-2-phenyl-pyridine-3-carboxylate Openeye Name: ethyl 4-ethyl-5-ethylsulfanylcarbonyl-6-(2-methoxyethyl)-2-phenyl-pyridine-3-carboxylate CAS Name: 4-ethyl-5-[(ethylthio)-oxomethyl]-6-(2-methoxyethyl)-2-phenyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-ethylsulfanylcarbonyl-6-(2-methoxyethyl)-2-phenylpyridine-3-carboxylate Traditional Name: 4-ethyl-5-(ethylthio)carbonyl-6-(2-methoxyethyl)-2-phenyl-nicotinic acid ethyl ester Formula: C22H27NO4S MolecularWeight: 401.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=C1C(=O)SCC)CCOC)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC(=C1C(=O)SCC)CCOC)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C22H27NO4S/c1-5-16-18(22(25)28-7-3)17(13-14-26-4)23-20(15-11-9-8-10-12-15)19(16)21(24)27-6-2/h8-12H,5-7,13-14H2,1-4H3