Vitas-M small molecule compound
(4-{(Z)-[6-(ethoxycarbonyl)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL164274
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)SC)c(=O)/c(=C/c1ccc(cc1)OCC(=O)O)/s2
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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 C26H24N2O6S2 MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S2/c1-4-33-25(32)22-15(2)27-26-28(23(22)17-7-11-19(35-3)12-8-17)24(31)20(36-26)13-16-5-9-18(10-6-16)34-14-21(29)30/h5-13,23H,4,14H2,1-3H3,(H,29,30)/b20-13-InChIKey
RAHUOJTWCHPLKH-MOSHPQCFSA-NSynonyms
(4((Z)(6(ETHOXYCARBONYL)7METHYL5(4(METHYLSULFANYL)PHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)PHENOXY)ACETICACID
2(4((Z)(6ETHOXYCARBONYL7METHYL5(4METHYLSULFANYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)PHENOXY)ACETICACID
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)SC)c(=O)c(=Cc1ccc(cc1)OCC(=O)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)C(=CC4=CC=C(C=C4)OCC(=O)O)S2)C
InChI=1SC26H24N2O6S2c143325(32)2215(2)272628(23(22)1771119(353)12817)24(31)20(3626)13165918(10616)341421(29)30h51323H414H213H3(H2930)b2013
MFCD03170029
ZINC000002049560
ZINC000002049562
Check stock
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Check stock on Vitas-MAvailable files
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