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S-(pyridin-3-ylmethyl) benzenecarbothioate

S-(pyridin-3-ylmethyl) benzenecarbothioate

Systemtic Name:S-(pyridin-3-ylmethyl) benzenecarbothioate
Openeye Name:S-(3-pyridylmethyl) benzenecarbothioate
CAS Name:benzenecarbothioic acid S-(3-pyridinylmethyl) ester
IUPAC Name:S-(pyridin-3-ylmethyl) benzenecarbothioate
Traditional Name:thiobenzoic acid S-(3-pyridylmethyl) ester
Formula: C13H11NOS
MolecularWeight: 229.29754
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCC2=CN=CC=C2


Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCC2=CN=CC=C2


InChI

InChI=1S/C13H11NOS/c15-13(12-6-2-1-3-7-12)16-10-11-5-4-8-14-9-11/h1-9H,10H2


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