CHEBI:108476 - 4-[2-[[2-[[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]amino]-2-oxoethyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester

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ChEBI Name 4-[2-[[2-[[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]amino]-2-oxoethyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester
ChEBI ID CHEBI:108476
Stars This entity has been manually annotated by a third party.
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Formula C21H24N4O6S2
Net Charge 0
Average Mass 492.571
Monoisotopic Mass 492.11373
InChI InChI=1S/C21H24N4O6S2/c1-2-29-21(28)25-7-5-24(6-8-25)19(27)12-32-11-18(26)23-20-22-15(10-33-20)14-3-4-16-17(9-14)31-13-30-16/h3-4,9-10H,2,5-8,11-13H2,1H3,(H,22,23,26)
InChIKey UWTSACVETMMCEI-UHFFFAOYSA-N
SMILES CCOC(=O)N1CCN(CC1)C(=O)CSCC(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4
ChEBI Ontology
Outgoing 4-[2-[[2-[[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]amino]-2-oxoethyl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:108476) is a benzodioxoles (CHEBI:38298)
Manual Xref Database
LSM-19852 LINCS
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