Vitas-M small molecule compound

5-butyl-3-[2-(4-methoxyphenyl)ethyl]-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl pentanoate

Catalog ID
STL032898
SMILES CCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCC)cccc3)CCc1ccc(cc1)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 C30H34N4O3 MW 498.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O3/c1-4-6-12-26-32-29-28(30-31-23-10-8-9-11-24(23)34(26)30)25(37-27(35)13-7-5-2)20-33(29)19-18-21-14-16-22(36-3)17-15-21/h8-11,14-17,20H,4-7,12-13,18-19H2,1-3H3
InChIKey
CBCAUCVJLPLGRO-UHFFFAOYSA-N
Synonyms
885197-70-6
5butyl3(2(4methoxyphenyl)ethyl)3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylpentanoate
5butyl3(4methoxyphenethyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylpentanoate
885197706
CCCCC1=NC2=C(C(=CN2CCC3=CC=C(C=C3)OC)OC(=O)CCCC)C4=NC5=CC=CC=C5N14
InChI=1SC30H34N4O3c1461226322928(30312310891124(23)34(26)30)25(3727(35)13752)2033(29)191821141622(363)171521h811141720H4712131819H213H3
MFCD06605423
ZINC000009124086
ZINC09124086
ZINC9124086

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Available files

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