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5-ethanoyl-6-methyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyridine-3-carbonitrile

5-ethanoyl-6-methyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name:5-ethanoyl-6-methyl-2-[(E)-3-phenylprop-2-enyl]sulfanyl-pyridine-3-carbonitrile
Openeye Name:5-acetyl-2-[(E)-cinnamyl]sulfanyl-6-methyl-pyridine-3-carbonitrile
CAS Name:5-acetyl-6-methyl-2-[[(E)-3-phenylprop-2-enyl]thio]-3-pyridinecarbonitrile
IUPAC Name:5-acetyl-6-methyl-2-[(E)-3-phenylprop-2-enyl]sulfanylpyridine-3-carbonitrile
Traditional Name:5-acetyl-2-[[(E)-cinnamyl]thio]-6-methyl-nicotinonitrile
Formula: C18H16N2OS
MolecularWeight: 308.39744
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC=CC2=CC=CC=C2)C#N)C(=O)C


Isomeric SMILES

CC1=C(C=C(C(=N1)SC/C=C/C2=CC=CC=C2)C#N)C(=O)C


InChI

InChI=1S/C18H16N2OS/c1-13-17(14(2)21)11-16(12-19)18(20-13)22-10-6-9-15-7-4-3-5-8-15/h3-9,11H,10H2,1-2H3/b9-6+


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