(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=C(N=CC=C2)SC)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)COC(=O)C2=C(N=CC=C2)SC)C

InChI

InChI=1S/C19H21NO3S/c1-11-9-12(2)17(14(4)21)13(3)16(11)10-23-19(22)15-7-6-8-20-18(15)24-5/h6-9H,10H2,1-5H3