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4-[[3-[Tert-butyl(dimethyl)silyl]oxycyclopentyl]amino]-2-methylsulfanylpyrimidine-5-carbonitrile

HCID 66955165
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Basic information

Standard SMILES
CSc1ncc(C#N)c(NC2CCC(O[Si](C)(C)C(C)(C)C)C2)n1
InChIKey
FNMXAWPAFGWNTE-UHFFFAOYSA-N
Molecular formula
C17H28N4OSSi
Average molar mass
364.6 g/mol

Names & identifiers

Preferred name
4-[[3-[Tert-butyl(dimethyl)silyl]oxycyclopentyl]amino]-2-methylsulfanylpyrimidine-5-carbonitrile
IUPAC
4-[[3-[tert-butyl(dimethyl)silyl]oxycyclopentyl]amino]-2-methylsulfanylpyrimidine-5-carbonitrile

Names & synonyms

SCHEMBL1225990

Database identifiers

PubChem CID
66955165

Properties

Computed structural propertiesFilling in

Topological polar surface area
96.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
473

Related reactions

1 records
New reaction record
HRID 1555249 reaction equation
HRID 1555249As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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