Vitas-M small molecule compound
(2E)-3-[2-(4-tert-butylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
Catalog ID
STK705459
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)/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 C28H30N4O3 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O3/c1-28(2,3)20-12-14-22(15-13-20)35-26-23(27(34)32-16-8-7-11-24(32)31-26)17-19(18-29)25(33)30-21-9-5-4-6-10-21/h7-8,11-17,21H,4-6,9-10H2,1-3H3,(H,30,33)/b19-17+InChIKey
IIJSTXYGZXNMDN-HTXNQAPBSA-NSynonyms
620104-88-3(2E)3(2(4tertbutylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylprop2enamide
(E)3(2(4(tertbutyl)phenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNcyclohexylacrylamide
(E)3(2(4TERTBUTYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANONCYCLOHEXYLPROP2ENAMIDE
620104883
CC(C)(C)C1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NC4CCCCC4
InChI=1SC28H30N4O3c128(23)20121422(151320)352623(27(34)3216871124(32)3126)1719(1829)25(33)302195461021h78111721H46910H213H3(H3033)b1917+
MFCD04164993
N#CC(=Cc1c(Oc2ccc(cc2)C(C)(C)C)nc2n(c1=O)cccc2)C(=O)NC1CCCCC1
ZINC000002411528
ZINC2411528
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