Vitas-M small molecule compound
5-butyl-3-[2-(4-fluorophenyl)ethyl]-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl pentanoate
Catalog ID
STK716176
SMILES CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)CCc1ccc(cc1)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 C29H31FN4O2 MW 486.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31FN4O2/c1-3-5-11-25-32-28-27(29-31-22-9-7-8-10-23(22)34(25)29)24(36-26(35)12-6-4-2)19-33(28)18-17-20-13-15-21(30)16-14-20/h7-10,13-16,19H,3-6,11-12,17-18H2,1-2H3InChIKey
OWAYLZQEMGAMRO-UHFFFAOYSA-NSynonyms
885203-96-35butyl3(2(4fluorophenyl)ethyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylpentanoate
5butyl3(4fluorophenethyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylpentanoate
885203963
CCCCC1=NC2=C(C(=CN2CCC3=CC=C(C=C3)F)OC(=O)CCCC)C4=NC5=CC=CC=C5N14
InChI=1SC29H31FN4O2c1351125322827(2931229781023(22)34(25)29)24(3626(35)12642)1933(28)181720131521(30)161420h710131619H3611121718H212H3
MFCD06593264
ZINC000009242727
ZINC09242727
ZINC9242727
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