Pyrrolidine, 1-[[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]-
Basic information
- CAS
459846-08-3- Standard SMILES
O=C(CSc1nnc(-c2cccs2)o1)N1CCCC1- InChIKey
FDJVAEJDENSEIB-UHFFFAOYSA-N- Molecular formula
- C12H13N3O2S2
- Average molar mass
- 295.4 g/mol
- Monoisotopic mass
- 295.04491901
Names & identifiers
- Preferred name
- Pyrrolidine, 1-[[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]-
- IUPAC
- 1-pyrrolidin-1-yl-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone
Names & synonyms
459846-08-3Pyrrolidine, 1-[[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]-F0594-03151-(PYRROLIDIN-1-YL)-2-{[5-(THIOPHEN-2-YL)-1,3,4-OXADIAZOL-2-YL]SULFANYL}ETHAN-1-ONE1-pyrrolidin-1-yl-2-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone1-(pyrrolidin-1-yl)-2-((5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl)thio)ethanoneDTXSID10366725HMS5092O10STK987370AKOS000667542CCG-128850Z24940716
Show more names
1-(pyrrolidin-1-yl)-2-{[5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}ethanone
Database identifiers
- CAS
459846-08-3- PubChem CID
- 2155759
- DTXSID
DTXSID10366725
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
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Related reactions
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Compound notes
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