methyl 5-ethanoyl-2,6-dimethyl-4-(2-methylsulfanylethyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 5-ethanoyl-2,6-dimethyl-4-(2-methylsulfanylethyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-acetyl-2,6-dimethyl-4-(2-methylsulfanylethyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-acetyl-2,6-dimethyl-4-[2-(methylthio)ethyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-2,6-dimethyl-4-(2-methylsulfanylethyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-acetyl-2,6-dimethyl-4-[2-(methylthio)ethyl]-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C14H21NO3S MolecularWeight: 283.38644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)CCSC)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)CCSC)C(=O)C

InChI

InChI=1S/C14H21NO3S/c1-8-12(10(3)16)11(6-7-19-5)13(9(2)15-8)14(17)18-4/h11,15H,6-7H2,1-5H3