CHEBI:109142 - 1-[4-amino-3-[2-(1-pyrrolidinyl)ethylthio]-5-thieno[2,3-c]isothiazolyl]ethanone

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ChEBI Name 1-[4-amino-3-[2-(1-pyrrolidinyl)ethylthio]-5-thieno[2,3-c]isothiazolyl]ethanone
ChEBI ID CHEBI:109142
Stars This entity has been manually annotated by a third party.
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Formula C13H17N3OS3
Net Charge 0
Average Mass 327.492
Monoisotopic Mass 327.05338
InChI InChI=1S/C13H17N3OS3/c1-8(17)11-10(14)9-12(19-11)15-20-13(9)18-7-6-16-4-2-3-5-16/h2-7,14H2,1H3
InChIKey WLGMOXHXQGODFR-UHFFFAOYSA-N
SMILES CC(=O)C1=C(C2=C(SN=C2S1)SCCN3CCCC3)N
ChEBI Ontology
Outgoing 1-[4-amino-3-[2-(1-pyrrolidinyl)ethylthio]-5-thieno[2,3-c]isothiazolyl]ethanone (CHEBI:109142) is a organonitrogen heterocyclic compound (CHEBI:38101)
1-[4-amino-3-[2-(1-pyrrolidinyl)ethylthio]-5-thieno[2,3-c]isothiazolyl]ethanone (CHEBI:109142) is a organosulfur heterocyclic compound (CHEBI:38106)
Manual Xref Database
LSM-20540 LINCS
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