CHEBI:114865 - 6-chloro-2-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinyl]-1H-benzimidazole

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ChEBI Name 6-chloro-2-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinyl]-1H-benzimidazole
ChEBI ID CHEBI:114865
Stars This entity has been manually annotated by a third party.
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Formula C20H20ClN3O4S
Net Charge 0
Average Mass 433.910
Monoisotopic Mass 433.08630
InChI InChI=1S/C20H20ClN3O4S/c21-14-1-3-16-17(11-14)23-20(22-16)13-5-7-24(8-6-13)29(25,26)15-2-4-18-19(12-15)28-10-9-27-18/h1-4,11-13H,5-10H2,(H,22,23)
InChIKey PTAVAGHPTJSPBH-UHFFFAOYSA-N
SMILES C1CN(CCC1C2=NC3=C(N2)C=C(C=C3)Cl)S(=O)(=O)C4=CC5=C(C=C4)OCCO5
ChEBI Ontology
Outgoing 6-chloro-2-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinyl]-1H-benzimidazole (CHEBI:114865) is a benzodioxine (CHEBI:64096)
Manual Xref Database
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