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methyl 4-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]benzoate

methyl 4-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]benzoate

Systemtic Name:methyl 4-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]benzoate
Openeye Name:methyl 4-[(3-cyano-6-methyl-2-pyridyl)sulfanylmethyl]benzoate
CAS Name:4-[[(3-cyano-6-methyl-2-pyridinyl)thio]methyl]benzoic acid methyl ester
IUPAC Name:methyl 4-[(3-cyano-6-methylpyridin-2-yl)sulfanylmethyl]benzoate
Traditional Name:4-[[(3-cyano-6-methyl-2-pyridyl)thio]methyl]benzoic acid methyl ester
Formula: C16H14N2O2S
MolecularWeight: 298.35956
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C#N)SCC2=CC=C(C=C2)C(=O)OC


Isomeric SMILES

CC1=NC(=C(C=C1)C#N)SCC2=CC=C(C=C2)C(=O)OC


InChI

InChI=1S/C16H14N2O2S/c1-11-3-6-14(9-17)15(18-11)21-10-12-4-7-13(8-5-12)16(19)20-2/h3-8H,10H2,1-2H3


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