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

Systemtic Name: ethyl 2-[(3-cyano-5-ethanoyl-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-acetyl-3-cyano-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)sulfanyl]acetate CAS Name: 2-[(5-acetyl-3-cyano-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-acetyl-3-cyano-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-acetyl-3-cyano-6-methyl-4-phenyl-1,4-dihydropyridin-2-yl)thio]acetic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-4-24-16(23)11-25-19-15(10-20)18(14-8-6-5-7-9-14)17(13(3)22)12(2)21-19/h5-9,18,21H,4,11H2,1-3H3