ethyl 4-ethyl-2-(2-fluorophenyl)-6-methyl-5-propan-2-ylsulfanylcarbonyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 4-ethyl-2-(2-fluorophenyl)-6-methyl-5-propan-2-ylsulfanylcarbonyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 4-ethyl-2-(2-fluorophenyl)-5-isopropylsulfanylcarbonyl-6-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-ethyl-2-(2-fluorophenyl)-6-methyl-5-[oxo-(propan-2-ylthio)methyl]-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-(2-fluorophenyl)-6-methyl-5-propan-2-ylsulfanylcarbonyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-ethyl-2-(2-fluorophenyl)-5-(isopropylthio)carbonyl-6-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C21H26FNO3S MolecularWeight: 391.499443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=C1C(=O)OCC)C2=CC=CC=C2F)C)C(=O)SC(C)C

Isomeric SMILES

CCC1C(=C(NC(=C1C(=O)OCC)C2=CC=CC=C2F)C)C(=O)SC(C)C

InChI

InChI=1S/C21H26FNO3S/c1-6-14-17(21(25)27-12(3)4)13(5)23-19(18(14)20(24)26-7-2)15-10-8-9-11-16(15)22/h8-12,14,23H,6-7H2,1-5H3