Vitas-M small molecule compound
(2E)-3-[2-(4-tert-butylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide
Catalog ID
STK800118
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)/C(=O)Nc1ccccc1C
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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 C29H26N4O3 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O3/c1-19-9-5-6-10-24(19)31-26(34)20(18-30)17-23-27(32-25-11-7-8-16-33(25)28(23)35)36-22-14-12-21(13-15-22)29(2,3)4/h5-17H,1-4H3,(H,31,34)/b20-17+InChIKey
VKAGMYPFTFACNK-LVZFUZTISA-NSynonyms
(2E)3(2(4tertbutylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoN(2methylphenyl)prop2enamide
(E)3(2(4tertbutylphenoxy)4oxopyrido(12a)pyrimidin3yl)2cyanoN(2methylphenyl)prop2enamide
CC1=CC=CC=C1NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=C(C=C4)C(C)(C)C)C#N
InChI=1SC29H26N4O3c1199561024(19)3126(34)20(1830)172327(322511781633(25)28(23)35)3622141221(131522)29(23)4h517H14H3(H3134)b2017+
MFCD04447072
N#CC(=Cc1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)C(=O)Nc1ccccc1C
ZINC000016735509
ZINC16735509
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