Vitas-M small molecule compound
3-(4-methylbenzyl)-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl hexanoate
Catalog ID
STK716090
SMILES CCCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCCC)cccc3)Cc1ccc(cc1)C
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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 C31H36N4O2 MW 496.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O2/c1-4-6-8-14-27-33-30-29(31-32-24-12-10-11-13-25(24)35(27)31)26(37-28(36)15-9-7-5-2)21-34(30)20-23-18-16-22(3)17-19-23/h10-13,16-19,21H,4-9,14-15,20H2,1-3H3InChIKey
GVMWJJZWOWKLLP-UHFFFAOYSA-NSynonyms
885197-09-13(4methylbenzyl)5pentyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylhexanoate
3(4methylbenzyl)5pentyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylhexanoate
885197091
CCCCCC1=NC2=C(C(=CN2CC3=CC=C(C=C3)C)OC(=O)CCCCC)C4=NC5=CC=CC=C5N14
InChI=1SC31H36N4O2c14681427333029(3132241210111325(24)35(27)31)26(3728(36)159752)2134(30)2023181622(3)171923h1013161921H49141520H213H3
MFCD06601700
ZINC000009243673
ZINC09243673
ZINC9243673
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