Vitas-M small molecule compound

3-{4-[3-(5-oxo-7,8-dihydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-13(5H)-yl)propanoyl]piperazin-1-yl}propanenitrile

Catalog ID
STL521621
SMILES N#CCCN1CCN(CC1)C(=O)CCn1c2ccccc2c2c1c1nc3ccccc3c(=O)n1CC2

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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 C28H28N6O2 MW 480.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N6O2/c29-12-5-13-31-16-18-32(19-17-31)25(35)11-15-33-24-9-4-2-6-20(24)21-10-14-34-27(26(21)33)30-23-8-3-1-7-22(23)28(34)36/h1-4,6-9H,5,10-11,13-19H2
InChIKey
CPYQESBEIULUKQ-UHFFFAOYSA-N
Synonyms

3(4(3(14oxo31321triazapentacyclo(11800^(210)0^(49)0^(1520))henicosa1(21)2(10)468151719octaen3yl)propanoyl)piperazin1yl)propanenitrile
3(4(3(5oxo78dihydroindolo(2334)pyrido(21b)quinazolin13(5H)yl)propanoyl)piperazin1yl)propanenitrile
3(4(3(5oxo78dihydroindolo(2334)pyrido(21b)quinazolin13(5H)yl)propanoyl)piperazin1yl)propanenitrilehydrochloride
71754860
InChI=1SC28H28N6O2c291251331161832(191731)25(35)11153324942620(24)2110143427(26(21)33)3023831722(23)28(34)36h1469H510111319H2
MFCD31752315
N#CCCN1CCN(CC1)C(=O)CCn1c2ccccc2c2c1c1nc3ccccc3c(=O)n1CC2Cl
ZINC000085877219
ZINC85877219

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Available files

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