CHEBI:104929 - 2-[2-[[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[2-[[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester
ChEBI ID CHEBI:104929
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H21N5O5S2
Net Charge 0
Average Mass 427.501
Monoisotopic Mass 427.09841
InChI InChI=1S/C16H21N5O5S2/c1-2-26-14(22)6-12-9-27-16(19-12)20-15(23)11-4-3-5-21(8-11)28(24,25)13-7-17-10-18-13/h7,9-11H,2-6,8H2,1H3,(H,17,18)(H,19,20,23)
InChIKey UQISEIMHWNPEJV-UHFFFAOYSA-N
SMILES CCOC(=O)CC1=CSC(=N1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CN=CN3
ChEBI Ontology
Outgoing 2-[2-[[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidinyl]-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester (CHEBI:104929) is a piperidinecarboxamide (CHEBI:48592)
Manual Xref Database
LSM-16292 LINCS
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