CHEBI:107997 - 6-ethoxy-3-[[[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-ethoxy-3-[[[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
ChEBI ID CHEBI:107997
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C24H30N6O2S
Net Charge 0
Average Mass 466.601
Monoisotopic Mass 466.21510
InChI InChI=1S/C24H30N6O2S/c1-5-24(3,4)30-22(26-27-28-30)16-29(15-20-8-7-11-33-20)14-18-12-17-13-19(32-6-2)9-10-21(17)25-23(18)31/h7-13H,5-6,14-16H2,1-4H3,(H,25,31)
InChIKey NXHUITDSVPREHK-UHFFFAOYSA-N
SMILES CCC(C)(C)N1C(=NN=N1)CN(CC2=CC=CS2)CC3=CC4=C(C=CC(=C4)OCC)NC3=O
ChEBI Ontology
Outgoing 6-ethoxy-3-[[[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl-(thiophen-2-ylmethyl)amino]methyl]-1H-quinolin-2-one (CHEBI:107997) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-19374 LINCS
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