CHEBI:108461 - 4-amino-2-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]isoindole-1,3-dione

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-amino-2-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]isoindole-1,3-dione
ChEBI ID CHEBI:108461
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H21N3O5S
Net Charge 0
Average Mass 427.475
Monoisotopic Mass 427.12019
InChI InChI=1S/C21H21N3O5S/c22-17-7-5-6-16-18(17)21(27)24(20(16)26)19(25)14-8-10-15(11-9-14)30(28,29)23-12-3-1-2-4-13-23/h5-11H,1-4,12-13,22H2
InChIKey PDCYSDOOWIRTJB-UHFFFAOYSA-N
SMILES C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3C(=O)C4=C(C3=O)C(=CC=C4)N
ChEBI Ontology
Outgoing 4-amino-2-[[4-(1-azepanylsulfonyl)phenyl]-oxomethyl]isoindole-1,3-dione (CHEBI:108461) is a phthalimides (CHEBI:82851)
Manual Xref Database
LSM-19837 LINCS
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