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6-(3,4-dimethoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile

6-(3,4-dimethoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile

Systemtic Name:6-(3,4-dimethoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carbonitrile
Openeye Name:2-benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile
CAS Name:6-(3,4-dimethoxyphenyl)-2-(phenylmethylthio)-3-pyridinecarbonitrile
IUPAC Name:2-benzylsulfanyl-6-(3,4-dimethoxyphenyl)pyridine-3-carbonitrile
Traditional Name:2-(benzylthio)-6-(3,4-dimethoxyphenyl)nicotinonitrile
Formula: C21H18N2O2S
MolecularWeight: 362.44482
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=C(C=C2)C#N)SCC3=CC=CC=C3)OC


Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=C(C=C2)C#N)SCC3=CC=CC=C3)OC


InChI

InChI=1S/C21H18N2O2S/c1-24-19-11-9-16(12-20(19)25-2)18-10-8-17(13-22)21(23-18)26-14-15-6-4-3-5-7-15/h3-12H,14H2,1-2H3


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