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5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)pyridine-3-carboxylate

5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)pyridine-3-carboxylate

Systemtic Name:5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)pyridine-3-carboxylate
Openeye Name:5-cyano-2-methyl-6-(3-pyridylmethylsulfanyl)pyridine-3-carboxylate
CAS Name:5-cyano-2-methyl-6-(3-pyridinylmethylthio)-3-pyridinecarboxylate
IUPAC Name:5-cyano-2-methyl-6-(pyridin-3-ylmethylsulfanyl)pyridine-3-carboxylate
Traditional Name:5-cyano-2-methyl-6-(3-pyridylmethylthio)nicotinate
Formula: C14H10N3O2S-
MolecularWeight: 284.3131
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=N1)SCC2=CN=CC=C2)C#N)C(=O)[O-]


Isomeric SMILES

CC1=C(C=C(C(=N1)SCC2=CN=CC=C2)C#N)C(=O)[O-]


InChI

InChI=1S/C14H11N3O2S/c1-9-12(14(18)19)5-11(6-15)13(17-9)20-8-10-3-2-4-16-7-10/h2-5,7H,8H2,1H3,(H,18,19)/p-1


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