Vitas-M small molecule compound
(2E)-3-[2-(3-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-[(4-methylphenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK704803
SMILES N#C/C(=C\c1c(Oc2cccc(c2)C)nc2n(c1=O)cccc2)/S(=O)(=O)c1ccc(cc1)C
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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 C25H19N3O4S MW 457.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O4S/c1-17-9-11-20(12-10-17)33(30,31)21(16-26)15-22-24(32-19-7-5-6-18(2)14-19)27-23-8-3-4-13-28(23)25(22)29/h3-15H,1-2H3/b21-15+InChIKey
XCVDDHIUQKSROP-RCCKNPSSSA-NSynonyms
620106-63-0(2E)3(2(3methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)2((4methylphenyl)sulfonyl)prop2enenitrile
(E)3(2(3METHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)2(4METHYLPHENYL)SULFONYLPROP2ENENITRILE
(E)3(4oxo2(mtolyloxy)4Hpyrido(12a)pyrimidin3yl)2tosylacrylonitrile
620106630
CC1=CC=C(C=C1)S(=O)(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)OC4=CC=CC(=C4)C)C#N
InChI=1SC25H19N3O4Sc11791120(121017)33(3031)21(1626)152224(321975618(2)1419)27238341328(23)25(22)29h315H12H3b2115+
MFCD04156819
N#CC(=Cc1c(Oc2cccc(c2)C)nc2n(c1=O)cccc2)S(=O)(=O)c1ccc(cc1)C
ZINC000002401987
ZINC2401987
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