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6-(phenylmethylsulfanyl)pyridine-3-carboxylate

6-(phenylmethylsulfanyl)pyridine-3-carboxylate

Systemtic Name:6-(phenylmethylsulfanyl)pyridine-3-carboxylate
Openeye Name:6-benzylsulfanylpyridine-3-carboxylate
CAS Name:6-(phenylmethylthio)-3-pyridinecarboxylate
IUPAC Name:6-benzylsulfanylpyridine-3-carboxylate
Traditional Name:6-(benzylthio)nicotinate
Formula: C13H10NO2S-
MolecularWeight: 244.289
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=C(C=C2)C(=O)[O-]


Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=C(C=C2)C(=O)[O-]


InChI

InChI=1S/C13H11NO2S/c15-13(16)11-6-7-12(14-8-11)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,15,16)/p-1


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