Vitas-M small molecule compound
5-butyl-3-(3-chloro-4-fluorophenyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl pentanoate
Catalog ID
STK716174
SMILES CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)c1ccc(c(c1)Cl)F
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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 C27H26ClFN4O2 MW 492.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClFN4O2/c1-3-5-11-23-31-26-25(27-30-20-9-7-8-10-21(20)33(23)27)22(35-24(34)12-6-4-2)16-32(26)17-13-14-19(29)18(28)15-17/h7-10,13-16H,3-6,11-12H2,1-2H3InChIKey
VDNKKWVQRXSKKR-UHFFFAOYSA-NSynonyms
885203-78-15butyl3(3chloro4fluorophenyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylpentanoate
5butyl3(3chloro4fluorophenyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylpentanoate
885203781
CCCCC1=NC2=C(C(=CN2C3=CC(=C(C=C3)F)Cl)OC(=O)CCCC)C4=NC5=CC=CC=C5N14
InChI=1SC27H26ClFN4O2c1351123312625(2730209781021(20)33(23)27)22(3524(34)12642)1632(26)17131419(29)18(28)1517h7101316H361112H212H3
MFCD06596504
ZINC000009243197
ZINC09243197
ZINC9243197
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