2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-4,5,6-trimethyl-pyridine-3-carbonitrile CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-4,5,6-trimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-4,5,6-trimethylpyridine-3-carbonitrile Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-4,5,6-trimethyl-nicotinonitrile Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC(=C(C(=C2C#N)C)C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC(=C(C(=C2C#N)C)C)C

InChI

InChI=1S/C20H22N2O2S/c1-6-24-19-8-7-16(15(5)23)9-17(19)11-25-20-18(10-21)13(3)12(2)14(4)22-20/h7-9H,6,11H2,1-5H3