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CHEBI:47653 - 4-[(6-CHLORO-1-BENZOTHIEN-2-YL)SULFONYL]-1-{[1-(2-HYDROXYETHYL)-1H-PYRROLO[3,2-C]PYRIDIN-2-YL]METHYL}PIPERAZIN-2-ONE

Default Structure
ChEBI IDCHEBI:47653
ChEBI Name4-[(6-CHLORO-1-BENZOTHIEN-2-YL)SULFONYL]-1-{[1-(2-HYDROXYETHYL)-1H-PYRROLO[3,2-C]PYRIDIN-2-YL]METHYL}PIPERAZIN-2-ONE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC22H21ClN4O4S2
Net Charge0
Average Mass505.021
Monoisotopic Mass504.06927
SMILES[H]OC([H])([H])C([H])([H])n1c(C([H])([H])N2C(=O)C([H])([H])N(S(=O)(=O)c3sc4c([H])c(Cl)c([H])c([H])c4c3[H])C([H])([H])C2([H])[H])c([H])c2c([H])nc([H])c([H])c21
InChIInChI=1S/C22H21ClN4O4S2/c23-17-2-1-15-10-22(32-20(15)11-17)33(30,31)26-6-5-25(21(29)14-26)13-18-9-16-12-24-4-3-19(16)27(18)7-8-28/h1-4,9-12,28H,5-8,13-14H2
InChIKeyNZNFLUOJACWZKX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[(6-CHLORO-1-BENZOTHIEN-2-YL)SULFONYL]-1-{[1-(2-HYDROXYETHYL)-1H-PYRROLO[3,2-C]PYRIDIN-2-YL]METHYL}PIPERAZIN-2-ONE (CHEBI:47653) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-[(6-CHLORO-1-BENZOTHIEN-2-YL)SULFONYL]-1-{[1-(2-HYDROXYETHYL)-1H-PYRROLO[3,2-C]PYRIDIN-2-YL]METHYL}PIPERAZIN-2-ONEPDBeChem
4-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-1-{[1-(2-hydroxyethyl)-1H-pyrrolo[3,2-c]pyridin-2-yl]methyl}piperazin-2-onePDBeChem
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