SC75741 (CHEBI:232877)

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CHEBI:232877 - SC75741

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ChEBI ID	CHEBI:232877
ChEBI Name	SC75741
Stars
Submitter	FlyBase
Downloads	Molfile

Formula	C29H23N7O2S2
Net Charge	0
Average Mass	565.684
Monoisotopic Mass	565.13546
SMILES	O=C(c1ccccc1)c1ccc2nc(/N=C(\O)c3csc(C4CCN(c5ncnc6ccsc56)CC4)n3)nc2c1
InChI	InChI=1S/C29H23N7O2S2/c37-24(17-4-2-1-3-5-17)19-6-7-20-22(14-19)34-29(33-20)35-27(38)23-15-40-28(32-23)18-8-11-36(12-9-18)26-25-21(10-13-39-25)30-16-31-26/h1-7,10,13-16,18H,8-9,11-12H2,(H2,33,34,35,38)
InChIKey	QNZVBFMXWNWVKG-UHFFFAOYSA-N

Roles Classification

Biological Role:

NF-kappaB inhibitor An inhibitor of NF-κB (nuclear factor κ-light-chain-enhancer of activated B cells), a protein complex involved in the transcription of DNA.

ChEBI Ontology

Outgoing Relation(s)
	SC75741 (CHEBI:232877) has role NF-κB inhibitor (CHEBI:73240)
	SC75741 (CHEBI:232877) is a organic molecular entity (CHEBI:50860)

IUPAC Name
N-(6-benzoyl-1H-benzimidazol-2-yl)-2-(1-thieno[3,2-d]pyrimidin-4-ylpiperidin-4-yl)-1,3-thiazole-4-carboxamide

Citations