Vitas-M small molecule compound

3-(3-methylphenyl)-5-pentyl-3H-pyrrolo[2',3':4,5]pyrimido[1,6-a]benzimidazol-1-yl hexanoate

Catalog ID
STK991224
SMILES CCCCCC(=O)Oc1cn(c2c1c1nc3c(n1c(n2)CCCCC)cccc3)c1cccc(c1)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 C30H34N4O2 MW 482.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O2/c1-4-6-8-17-26-32-29-28(30-31-23-15-10-11-16-24(23)34(26)30)25(36-27(35)18-9-7-5-2)20-33(29)22-14-12-13-21(3)19-22/h10-16,19-20H,4-9,17-18H2,1-3H3
InChIKey
FLMKZHCWGBLQBO-UHFFFAOYSA-N
Synonyms
885196-42-9
3(3methylphenyl)5pentyl3Hpyrrolo(2345)pyrimido(16a)benzimidazol1ylhexanoate
5pentyl3(mtolyl)3Hbenzo(45)imidazo(12c)pyrrolo(32e)pyrimidin1ylhexanoate
885196429
CCCCCC1=NC2=C(C(=CN2C3=CC=CC(=C3)C)OC(=O)CCCCC)C4=NC5=CC=CC=C5N14
InChI=1SC30H34N4O2c14681726322928(3031231510111624(23)34(26)30)25(3627(35)189752)2033(29)2214121321(3)1922h10161920H491718H213H3
MFCD06608202
ZINC000009124308
ZINC09124308
ZINC9124308

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Available files

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