Vitas-M small molecule compound

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

Catalog ID
STK716091
SMILES CCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCC)cccc3)Cc1ccccc1Cl

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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 C26H25ClN4O2 MW 460.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O2/c1-3-9-22-29-25-24(26-28-19-13-7-8-14-20(19)31(22)26)21(33-23(32)10-4-2)16-30(25)15-17-11-5-6-12-18(17)27/h5-8,11-14,16H,3-4,9-10,15H2,1-2H3
InChIKey
GVUFXOVRAFPQRZ-UHFFFAOYSA-N
Synonyms
885197-15-9
3(2chlorobenzyl)5propyl3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylbutyrate
3(2chlorobenzyl)5propyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylbutanoate
885197159
CCCC1=NC2=C(C(=CN2CC3=CC=CC=C3Cl)OC(=O)CCC)C4=NC5=CC=CC=C5N14
InChI=1SC26H25ClN4O2c13922292524(26281913781420(19)31(22)26)21(3323(32)1042)1630(25)151711561218(17)27h58111416H3491015H212H3
MFCD06591498
ZINC000009293025
ZINC09293025
ZINC9293025

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Available files

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