Vitas-M small molecule compound
(2E)-3-[2-(4-methoxyphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-(phenylsulfonyl)prop-2-enenitrile
Catalog ID
STK800883
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)OC)nc2n(c1=O)cccc2C)/S(=O)(=O)c1ccccc1
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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/c1-17-7-6-14-28-23(17)27-24(33-19-12-10-18(32-2)11-13-19)22(25(28)29)15-21(16-26)34(30,31)20-8-4-3-5-9-20/h3-15H,1-2H3/b21-15+InChIKey
GAAYETAIFSRKKU-RCCKNPSSSA-NSynonyms
620112-18-7(2E)3(2(4methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)prop2enenitrile
(E)2(BENZENESULFONYL)3(2(4METHOXYPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
(E)3(2(4methoxyphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2(phenylsulfonyl)acrylonitrile
620112187
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)S(=O)(=O)C3=CC=CC=C3)OC4=CC=C(C=C4)OC
InChI=1SC25H19N3O5Sc11776142823(17)2724(3319121018(322)111319)22(25(28)29)1521(1626)34(3031)208435920h315H12H3b2115+
MFCD04163268
N#CC(=Cc1c(Oc2ccc(cc2)OC)nc2n(c1=O)cccc2C)S(=O)(=O)c1ccccc1
ZINC000002409903
ZINC2409903
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