Vitas-M small molecule compound
3-(3,5-dihydroxy-1,2,4-triazin-6-yl)-1-{2-[1-(2-methylpropyl)-1H-benzimidazol-2-yl]pyrrolidin-1-yl}propan-1-one
Catalog ID
STL423556
SMILES Oc1nnc(c(n1)O)CCC(=O)N1CCCC1c1nc2c(n1CC(C)C)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H26N6O3 MW 410.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O3/c1-13(2)12-27-16-7-4-3-6-14(16)22-19(27)17-8-5-11-26(17)18(28)10-9-15-20(29)23-21(30)25-24-15/h3-4,6-7,13,17H,5,8-12H2,1-2H3,(H2,23,25,29,30)InChIKey
NOZBLDRCIXGNFA-UHFFFAOYSA-NSynonyms
3(35dihydroxy124triazin6yl)1(2(1(2methylpropyl)1Hbenzimidazol2yl)pyrrolidin1yl)propan1one
6(3(2(1(2methylpropyl)benzimidazol2yl)pyrrolidin1yl)3oxopropyl)2H124triazine35dione
CC(C)CN1C2=CC=CC=C2N=C1C3CCCN3C(=O)CCC4=NNC(=O)NC4=O
InChI=1SC21H26N6O3c113(2)122716743614(16)2219(27)17851126(17)18(28)1091520(29)2321(30)252415h34671317H5812H212H3(H223252930)
MFCD30708840
ZINC000218516282
ZINC000226847855
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