Vitas-M small molecule compound
(2E)-2-cyano-N-cyclohexyl-3-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide
Catalog ID
STK903803
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2)N1CCN(CC1)c1ccc(cc1)OC)/C(=O)NC1CCCCC1
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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 C29H32N6O3 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N6O3/c1-38-24-12-10-23(11-13-24)33-15-17-34(18-16-33)27-25(29(37)35-14-6-5-9-26(35)32-27)19-21(20-30)28(36)31-22-7-3-2-4-8-22/h5-6,9-14,19,22H,2-4,7-8,15-18H2,1H3,(H,31,36)/b21-19+InChIKey
OKIPZEXCJBBVTI-XUTLUUPISA-NSynonyms
796880-56-3(2E)2cyanoNcyclohexyl3(2(4(4methoxyphenyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyanoNcyclohexyl3(2(4(4methoxyphenyl)piperazin1yl)4oxo4Hpyrido(12a)pyrimidin3yl)acrylamide
(E)2CYANONCYCLOHEXYL3(2(4(4METHOXYPHENYL)PIPERAZIN1YL)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
796880563
COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=O)N4C=CC=CC4=N3)C=C(C#N)C(=O)NC5CCCCC5
InChI=1SC29H32N6O3c13824121023(111324)33151734(181633)2725(29(37)351465926(35)3227)1921(2030)28(36)31227324822h569141922H24781518H21H3(H3136)b2119+
MFCD03670208
N#CC(=Cc1c(nc2n(c1=O)cccc2)N1CCN(CC1)c1ccc(cc1)OC)C(=O)NC1CCCCC1
ZINC000009075345
ZINC9075345
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.