Vitas-M small molecule compound
(2E)-2-[(4-chlorophenyl)sulfonyl]-3-[2-(4-ethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Catalog ID
STK637382
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)CC)nc2n(c1=O)cccc2C)/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 C26H20ClN3O4S MW 505.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20ClN3O4S/c1-3-18-6-10-20(11-7-18)34-25-23(26(31)30-14-4-5-17(2)24(30)29-25)15-22(16-28)35(32,33)21-12-8-19(27)9-13-21/h4-15H,3H2,1-2H3/b22-15+InChIKey
LOIFXVBWLQFXKS-PXLXIMEGSA-NSynonyms
620113-15-7(2E)2((4chlorophenyl)sulfonyl)3(2(4ethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)prop2enenitrile
(E)2((4chlorophenyl)sulfonyl)3(2(4ethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)acrylonitrile
(E)2(4CHLOROPHENYL)SULFONYL3(2(4ETHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
620113157
CCC1=CC=C(C=C1)OC2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)S(=O)(=O)C4=CC=C(C=C4)Cl
InChI=1SC26H20ClN3O4Sc131861020(11718)342523(26(31)30144517(2)24(30)2925)1522(1628)35(3233)2112819(27)91321h415H3H212H3b2215+
MFCD05690345
N#CC(=Cc1c(Oc2ccc(cc2)CC)nc2n(c1=O)cccc2C)S(=O)(=O)c1ccc(cc1)Cl
ZINC000013806591
ZINC13806591
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