3-Benzylamino-2-(1-hydroxyethyl)-5-trimethylsilyl-4-pentinic acid phenylthio ester

HCID 54532351
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Basic information

Standard SMILES
CC(O)C(C(=O)OSc1ccccc1)C(C#C[Si](C)(C)C)NCc1ccccc1
InChIKey
YXKGJDFKPSZYFU-UHFFFAOYSA-N
Molecular formula
C23H29NO3SSi
Average molar mass
427.6 g/mol

Names & identifiers

Preferred name
3-Benzylamino-2-(1-hydroxyethyl)-5-trimethylsilyl-4-pentinic acid phenylthio ester
IUPAC
phenylsulfanyl 3-(benzylamino)-2-(1-hydroxyethyl)-5-trimethylsilylpent-4-ynoate

Names & synonyms

SCHEMBL9663917YXKGJDFKPSZYFU-UHFFFAOYSA-N3-benzylamino-2-(1-hydroxyethyl)-5-trimethylsilyl-4-pentinic acid phenylthio ester3-benzylamino-2-(1-hydroxyethyl)-5-trimethylsilyl-4-pentinic acid phenylthioester

Database identifiers

PubChem CID
54532351

Properties

Computed structural properties

Topological polar surface area
83.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
29

Related reactions

2 records
New reaction record

Linked notes

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