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CHEBI:44148 - 3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDE

Default Structure
ChEBI IDCHEBI:44148
ChEBI Name3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H22N6O3S
Net Charge0
Average Mass402.480
Monoisotopic Mass402.14741
SMILES[H]c1c([H])c(N([H])c2nc(OC([H])([H])C3([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C3([H])[H])c3nc([H])n([H])c3n2)c([H])c(S(=O)(=O)N([H])[H])c1[H]
InChIInChI=1S/C18H22N6O3S/c19-28(25,26)14-8-4-7-13(9-14)22-18-23-16-15(20-11-21-16)17(24-18)27-10-12-5-2-1-3-6-12/h4,7-9,11-12H,1-3,5-6,10H2,(H2,19,25,26)(H2,20,21,22,23,24)
InChIKeyBKDUVKJYBJDZQW-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDE (CHEBI:44148) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDEPDBeChem
3-{[6-(cyclohexylmethoxy)-9H-purin-2-yl]amino}benzenesulfonamidePDBeChem
Manual XrefsDatabases
N76PDBeChem