2-t-Butylthio-3-cyano-5-ethylpyridine

HCID 19086252
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Basic information

Standard SMILES
CCc1cnc(SC(C)(C)C)c(C#N)c1
InChIKey
BYLXDCUZWTZBPD-UHFFFAOYSA-N
Molecular formula
C12H16N2S
Average molar mass
220.34 g/mol

Names & identifiers

Preferred name
2-t-Butylthio-3-cyano-5-ethylpyridine
IUPAC
2-tert-butylsulfanyl-5-ethylpyridine-3-carbonitrile

Names & synonyms

SCHEMBL9432186BYLXDCUZWTZBPD-UHFFFAOYSA-N2-t-butylthio-3-cyano-5-ethylpyridine139548-61-1DB-3763352-[(1,1-Dimethylethyl)thio]-5-ethyl-3-pyridinecarbonitrile

Database identifiers

PubChem CID
19086252

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
62 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Related reactions

2 records
New reaction record

Compound notes

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