CHEBI:107204 - 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]acetamide

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ChEBI Name 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]acetamide
ChEBI ID CHEBI:107204
Stars This entity has been manually annotated by a third party.
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Formula C24H25N5O4S2
Net Charge 0
Average Mass 511.619
Monoisotopic Mass 511.13480
InChI InChI=1S/C24H25N5O4S2/c1-15-16(2)28-33-23(15)29-35(31,32)20-10-8-19(9-11-20)26-22(30)14-34-24-18(13-25)12-17-6-4-3-5-7-21(17)27-24/h8-12,29H,3-7,14H2,1-2H3,(H,26,30)
InChIKey HAFBNDMAOWSKGB-UHFFFAOYSA-N
SMILES CC1=C(ON=C1C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CSC3=NC4=C(CCCCC4)C=C3C#N
ChEBI Ontology
Outgoing 2-[(3-cyano-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-2-yl)thio]-N-[4-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]phenyl]acetamide (CHEBI:107204) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-18558 LINCS
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