Vitas-M small molecule compound

3-(3-chloro-4-methoxyphenyl)-5-propyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl butanoate

Catalog ID
STK716155
SMILES CCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCC)cccc3)c1ccc(c(c1)Cl)OC

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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 C26H25ClN4O3 MW 476.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O3/c1-4-8-22-29-25-24(26-28-18-10-6-7-11-19(18)31(22)26)21(34-23(32)9-5-2)15-30(25)16-12-13-20(33-3)17(27)14-16/h6-7,10-15H,4-5,8-9H2,1-3H3
InChIKey
AHGSWEJEKSTHFK-UHFFFAOYSA-N
Synonyms
885202-39-1
3(3chloro4methoxyphenyl)5propyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylbutyrate
3(3chloro4methoxyphenyl)5propyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylbutanoate
885202391
CCCC1=NC2=C(C(=CN2C3=CC(=C(C=C3)OC)Cl)OC(=O)CCC)C4=NC5=CC=CC=C5N14
InChI=1SC26H25ClN4O3c14822292524(26281810671119(18)31(22)26)21(3423(32)952)1530(25)16121320(333)17(27)1416h671015H4589H213H3
MFCD06591732
ZINC000009293057
ZINC09293057
ZINC9293057

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Available files

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