CHEBI:116475 - 3-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-oxolanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-oxolanone
ChEBI ID CHEBI:116475
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C14H15N3O2S2
Net Charge 0
Average Mass 321.421
Monoisotopic Mass 321.06057
InChI InChI=1S/C14H15N3O2S2/c1-2-9-3-5-10(6-4-9)15-13-16-17-14(21-13)20-11-7-8-19-12(11)18/h3-6,11H,2,7-8H2,1H3,(H,15,16)
InChIKey SPYVAJANGRMILJ-UHFFFAOYSA-N
SMILES CCC1=CC=C(C=C1)NC2=NN=C(S2)SC3CCOC3=O
ChEBI Ontology
Outgoing 3-[[5-(4-ethylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-oxolanone (CHEBI:116475) is a aryl sulfide (CHEBI:35683)
Manual Xref Database
LSM-27929 LINCS
View more database links