Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-5-propyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl butanoate
Catalog ID
STK716094
SMILES CCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCC)cccc3)Cc1ccc2c(c1)OCO2
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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 C27H26N4O4 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4/c1-3-7-23-29-26-25(27-28-18-9-5-6-10-19(18)31(23)27)22(35-24(32)8-4-2)15-30(26)14-17-11-12-20-21(13-17)34-16-33-20/h5-6,9-13,15H,3-4,7-8,14,16H2,1-2H3InChIKey
PZCCKKUONJMMLY-UHFFFAOYSA-NSynonyms
885197-35-33(13benzodioxol5ylmethyl)5propyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylbutanoate
3(benzo(d)(13)dioxol5ylmethyl)5propyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylbutyrate
885197353
CCCC1=NC2=C(C(=CN2CC3=CC4=C(C=C3)OCO4)OC(=O)CCC)C5=NC6=CC=CC=C6N15
InChI=1SC27H26N4O4c13723292625(2728189561019(18)31(23)27)22(3524(32)842)1530(26)141711122021(1317)34163320h5691315H34781416H212H3
MFCD06611413
ZINC000009124563
ZINC09124563
ZINC9124563
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