Vitas-M small molecule compound
5-butyl-3-(4-methylphenyl)-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl pentanoate
Catalog ID
STK991221
SMILES CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)c1ccc(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 C28H30N4O2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2/c1-4-6-12-24-30-27-26(28-29-21-10-8-9-11-22(21)32(24)28)23(34-25(33)13-7-5-2)18-31(27)20-16-14-19(3)15-17-20/h8-11,14-18H,4-7,12-13H2,1-3H3InChIKey
UPWPBHKVOYEVMW-UHFFFAOYSA-NSynonyms
850803-45-15butyl3(4methylphenyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylpentanoate
5butyl3(ptolyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylpentanoate
850803451
CCCCC1=NC2=C(C(=CN2C3=CC=C(C=C3)C)OC(=O)CCCC)C4=NC5=CC=CC=C5N14
InChI=1SC28H30N4O2c1461224302726(28292110891122(21)32(24)28)23(3425(33)13752)1831(27)20161419(3)151720h8111418H471213H213H3
MFCD05695730
ZINC000009291634
ZINC09291634
ZINC9291634
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