ethyl 2-[[3-cyano-5-ethanoyl-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[3-cyano-5-ethanoyl-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-acetyl-3-cyano-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate CAS Name: 2-[[5-acetyl-3-cyano-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-acetyl-3-cyano-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-acetyl-3-cyano-4-(4-fluorophenyl)-6-methyl-1,4-dihydropyridin-2-yl]thio]acetic acid ethyl ester Formula: C19H19FN2O3S MolecularWeight: 374.429163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)C)C2=CC=C(C=C2)F)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C(C(=C(N1)C)C(=O)C)C2=CC=C(C=C2)F)C#N

InChI

InChI=1S/C19H19FN2O3S/c1-4-25-16(24)10-26-19-15(9-21)18(13-5-7-14(20)8-6-13)17(12(3)23)11(2)22-19/h5-8,18,22H,4,10H2,1-3H3