Vitas-M small molecule compound
(2E)-2-[(4-chlorophenyl)sulfonyl]-3-[9-methyl-2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Catalog ID
STK799665
SMILES N#C/C(=C\c1c(Oc2ccc(cc2)C)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 C25H18ClN3O4S MW 491.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O4S/c1-16-5-9-19(10-6-16)33-24-22(25(30)29-13-3-4-17(2)23(29)28-24)14-21(15-27)34(31,32)20-11-7-18(26)8-12-20/h3-14H,1-2H3/b21-14+InChIKey
XKHNUTHNPQBMCP-KGENOOAVSA-NSynonyms
620111-88-8(2E)2((4chlorophenyl)sulfonyl)3(9methyl2(4methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enenitrile
(E)2((4chlorophenyl)sulfonyl)3(9methyl4oxo2(ptolyloxy)4Hpyrido(12a)pyrimidin3yl)acrylonitrile
(E)2(4CHLOROPHENYL)SULFONYL3(9METHYL2(4METHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENENITRILE
620111888
CC1=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=1SC25H18ClN3O4Sc1165919(10616)332422(25(30)29133417(2)23(29)2824)1421(1527)34(3132)2011718(26)81220h314H12H3b2114+
MFCD04163516
N#CC(=Cc1c(Oc2ccc(cc2)C)nc2n(c1=O)cccc2C)S(=O)(=O)c1ccc(cc1)Cl
ZINC000013768300
ZINC13768300
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