Vitas-M small molecule compound
(2E)-3-[2-(2-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK704869
SMILES COc1ccccc1Oc1nc2c(C)cccn2c(=O)c1/C=C(/S(=O)(=O)c1ccccc1)\C#N
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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 C25H19N3O5S MW 473.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O5S/c1-17-9-8-14-28-23(17)27-24(33-22-13-7-6-12-21(22)32-2)20(25(28)29)15-19(16-26)34(30,31)18-10-4-3-5-11-18/h3-15H,1-2H3/b19-15+InChIKey
DTRPWNYJNNFPGS-XDJHFCHBSA-NSynonyms
620537-94-2(2E)3(2(2methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)prop2enenitrile
(E)2(BENZENESULFONYL)3(2(2METHOXYPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)3(2(2methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)acrylonitrile
620537942
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4OC
COc1ccccc1Oc1nc2c(C)cccn2c(=O)c1C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC25H19N3O5Sc11798142823(17)2724(332213761221(22)322)20(25(28)29)1519(1626)34(3031)18104351118h315H12H3b1915+
MFCD04195415
ZINC000002433273
ZINC2433273
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