Vitas-M small molecule compound
(5Z)-5-{4-[(4-chlorobenzyl)oxy]benzylidene}-1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK571002
SMILES N#CC1=C(C)/C(=C/c2ccc(cc2)OCc2ccc(cc2)Cl)/C(=O)N(C1=O)C1CCS(=O)(=O)C1
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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 C25H21ClN2O5S MW 496.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O5S/c1-16-22(24(29)28(25(30)23(16)13-27)20-10-11-34(31,32)15-20)12-17-4-8-21(9-5-17)33-14-18-2-6-19(26)7-3-18/h2-9,12,20H,10-11,14-15H2,1H3/b22-12-InChIKey
QUNRDYCPVGRBCD-UUYOSTAYSA-NSynonyms
(5Z)5((4((4CHLOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1(11DIOXOTHIOLAN3YL)4METHYL26DIOXOPYRIDINE3CARBONITRILE
(5Z)5(4((4chlorobenzyl)oxy)benzylidene)1(11dioxidotetrahydrothiophen3yl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(Z)5(4((4chlorobenzyl)oxy)benzylidene)1(11dioxidotetrahydrothiophen3yl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)C4CCS(=O)(=O)C4)C#N
InChI=1SC25H21ClN2O5Sc11622(24(29)28(25(30)23(16)1327)20101134(3132)1520)12174821(9517)3314182619(26)7318h291220H10111415H21H3b2212
MFCD05698831
N#CC1=C(C)C(=Cc2ccc(cc2)OCc2ccc(cc2)Cl)C(=O)N(C1=O)C1CCS(=O)(=O)C1
ZINC000009344357
ZINC000013811041
Check stock
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Check stock on Vitas-MAvailable files
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