Vitas-M small molecule compound
(2E)-3-[2-(4-bromophenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
Catalog ID
STK818947
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2C)/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 C25H23BrN4O3 MW 507.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN4O3/c1-16-6-5-13-30-22(16)29-24(33-20-11-9-18(26)10-12-20)21(25(30)32)14-17(15-27)23(31)28-19-7-3-2-4-8-19/h5-6,9-14,19H,2-4,7-8H2,1H3,(H,28,31)/b17-14+InChIKey
ZPFIMEOMYSMSFA-SAPNQHFASA-NSynonyms
620111-44-6(2E)3(2(4bromophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylprop2enamide
(E)3(2(4bromophenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylacrylamide
(E)3(2(4BROMOPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANONCYCLOHEXYLPROP2ENAMIDE
620111446
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NC3CCCCC3)OC4=CC=C(C=C4)Br
InChI=1SC25H23BrN4O3c11665133022(16)2924(332011918(26)101220)21(25(30)32)1417(1527)23(31)28197324819h5691419H2478H21H3(H2831)b1714+
MFCD04448130
N#CC(=Cc1c(Oc2ccc(cc2)Br)nc2n(c1=O)cccc2C)C(=O)NC1CCCCC1
ZINC000009344623
ZINC9344623
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