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CHEBI:232621 - MIND4-17

Default Structure
ChEBI IDCHEBI:232621
ChEBI NameMIND4-17
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FormulaC20H15N5O3S
Net Charge0
Average Mass405.439
Monoisotopic Mass405.08956
SMILESO=[N+]([O-])c1ccc(Sc2nnc(COc3ccccc3)n2-c2ccccc2)nc1
InChIInChI=1S/C20H15N5O3S/c26-25(27)16-11-12-19(21-13-16)29-20-23-22-18(14-28-17-9-5-2-6-10-17)24(20)15-7-3-1-4-8-15/h1-13H,14H2
InChIKeyOZUBDKIROJPQGE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
MIND4-17 (CHEBI:232621) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
5-nitro-2-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]pyridine
Synonym  Source
5-nitro-2-{[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio}pyridineSUBMITTER
Citations