CHEBI:91962 - 2-(4-bromophenyl)-2-hydroxy-1-[4-(1H-indazol-5-ylamino)-1-piperidinyl]ethanone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(4-bromophenyl)-2-hydroxy-1-[4-(1H-indazol-5-ylamino)-1-piperidinyl]ethanone
ChEBI ID CHEBI:91962
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C20H21BrN4O2
Net Charge 0
Average Mass 429.311
Monoisotopic Mass 428.08479
InChI InChI=1S/C20H21BrN4O2/c21-15-3-1-13(2-4-15)19(26)20(27)25-9-7-16(8-10-25)23-17-5-6-18-14(11-17)12-22-24-18/h1-6,11-12,16,19,23,26H,7-10H2,(H,22,24)
InChIKey NQYWUAZXGFMIIN-UHFFFAOYSA-N
SMILES C1CN(CCC1NC2=CC3=C(C=C2)NN=C3)C(=O)C(C4=CC=C(C=C4)Br)O
ChEBI Ontology
Outgoing 2-(4-bromophenyl)-2-hydroxy-1-[4-(1H-indazol-5-ylamino)-1-piperidinyl]ethanone (CHEBI:91962) is a acetamides (CHEBI:22160)
Manual Xref Database
LSM-1916 LINCS
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