CHEBI:107950 - 3-[5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]isoxazole

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]isoxazole
ChEBI ID CHEBI:107950
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H16N4O3S2
Net Charge 0
Average Mass 376.456
Monoisotopic Mass 376.06638
InChI InChI=1S/C16H16N4O3S2/c21-25(22,16-5-4-14(24-16)13-6-12-23-18-13)20-10-8-19(9-11-20)15-3-1-2-7-17-15/h1-7,12H,8-11H2
InChIKey YYZSRKMWHVINIW-UHFFFAOYSA-N
SMILES C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)C3=CC=C(S3)C4=NOC=C4
ChEBI Ontology
Outgoing 3-[5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]isoxazole (CHEBI:107950) is a piperazines (CHEBI:26144)
3-[5-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]-2-thiophenyl]isoxazole (CHEBI:107950) is a pyridines (CHEBI:26421)
Manual Xref Database
LSM-19327 LINCS
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