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CHEBI:39727 - N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide

ChEBI IDCHEBI:39727
ChEBI NameN-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide
Stars
ASCII NameN-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide
Last Modified7 January 2015
DownloadsMolfile
FormulaC22H24N6O3
Net Charge0
Average Mass420.473
Monoisotopic Mass420.19099
SMILES[H]c1nc([H])n(-c2nc(N3C([H])([H])C([H])([H])C([H])([H])[C@]3([H])C(=O)N([H])C([H])([H])C([H])([H])c3c([H])c([H])c4c(c3[H])OC([H])([H])O4)c([H])c(C([H])([H])[H])n2)c1[H]
InChIInChI=1S/C22H24N6O3/c1-15-11-20(26-22(25-15)27-10-8-23-13-27)28-9-2-3-17(28)21(29)24-7-6-16-4-5-18-19(12-16)31-14-30-18/h4-5,8,10-13,17H,2-3,6-7,9,14H2,1H3,(H,24,29)/t17-/m1/s1
InChIKeyLBCGUKCXRVUULK-QGZVFWFLSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide (CHEBI:39727) is a D-proline derivative (CHEBI:84185)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide (CHEBI:39727) is a aminopyrimidine (CHEBI:38338)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide (CHEBI:39727) is a benzodioxoles (CHEBI:38298)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide (CHEBI:39727) is a imidazoles (CHEBI:24780)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamide (CHEBI:39727) is a pyrrolidinecarboxamide (CHEBI:46770)
Synonyms  Source
N-[2-(1,3-BENZODIOXOL-5-YL)ETHYL]-1-[2-(1H-IMIDAZOL-1-YL)-6-METHYLPYRIMIDIN-4-YL]-D-PROLINAMIDEPDBeChem
N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1H-imidazol-1-yl)-6-methylpyrimidin-4-yl]-D-prolinamidePDBeChem
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