CHEBI:108422 - 2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-N-(2-furanylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-N-(2-furanylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
ChEBI ID CHEBI:108422
Stars This entity has been manually annotated by a third party.
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Formula C25H23N3O5S
Net Charge 0
Average Mass 477.534
Monoisotopic Mass 477.13584
InChI InChI=1S/C25H23N3O5S/c29-20(11-4-12-28-24(31)16-7-1-2-8-17(16)25(28)32)27-23-21(18-9-3-10-19(18)34-23)22(30)26-14-15-6-5-13-33-15/h1-2,5-8,13H,3-4,9-12,14H2,(H,26,30)(H,27,29)
InChIKey BTNOGGLWFRDYAX-UHFFFAOYSA-N
SMILES C1CC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)CCCN4C(=O)C5=CC=CC=C5C4=O
ChEBI Ontology
Outgoing 2-[[4-(1,3-dioxo-2-isoindolyl)-1-oxobutyl]amino]-N-(2-furanylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide (CHEBI:108422) is a phthalimides (CHEBI:82851)
Manual Xref Database
LSM-19798 LINCS
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