Vitas-M small molecule compound
(2E)-3-[2-(azepan-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK589066
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/S(=O)(=O)c1ccc(cc1)Cl
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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 C24H23ClN4O3S MW 482.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN4O3S/c1-17-7-6-14-29-22(17)27-23(28-12-4-2-3-5-13-28)21(24(29)30)15-20(16-26)33(31,32)19-10-8-18(25)9-11-19/h6-11,14-15H,2-5,12-13H2,1H3/b20-15+InChIKey
SGMJGBKHUCJRIP-HMMYKYKNSA-NSynonyms
896598-39-3(2E)3(2(azepan1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2((4chlorophenyl)sulfonyl)prop2enenitrile
(E)3(2(azepan1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2((4chlorophenyl)sulfonyl)acrylonitrile
(E)3(2(AZEPAN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2(4CHLOROPHENYL)SULFONYLPROP2ENENITRILE
896598393
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl)N4CCCCCC4
InChI=1SC24H23ClN4O3Sc11776142922(17)2723(281242351328)21(24(29)30)1520(1626)33(3132)1910818(25)91119h6111415H251213H21H3b2015+
MFCD03670178
N#CC(=Cc1c(nc2n(c1=O)cccc2C)N1CCCCCC1)S(=O)(=O)c1ccc(cc1)Cl
ZINC000009242765
ZINC9242765
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