Vitas-M small molecule compound
4-(5-{(Z)-[6-(ethoxycarbonyl)-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK064032
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)C(=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 C28H22N2O6S MW 514.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O6S/c1-3-35-27(34)23-16(2)29-28-30(24(23)18-7-5-4-6-8-18)25(31)22(37-28)15-20-13-14-21(36-20)17-9-11-19(12-10-17)26(32)33/h4-15,24H,3H2,1-2H3,(H,32,33)/b22-15-InChIKey
SLLFRGFUJSGQFU-JCMHNJIXSA-NSynonyms
(E)4(5((6(ethoxycarbonyl)7methyl3oxo5phenyl35dihydro2Hthiazolo(32a)pyrimidin2ylidene)methyl)furan2yl)benzoicacid
4(5((Z)(6(ETHOXYCARBONYL)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDIN2(3H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
4(5((Z)(6ETHOXYCARBONYL7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)FURAN2YL)BENZOICACID
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)C(=O)O)S2)C
InChI=1SC28H22N2O6Sc133527(34)2316(2)292830(24(23)187546818)25(31)22(3728)1520131421(3620)1791119(121017)26(32)33h41524H3H212H3(H3233)b2215
MFCD01455421
STK064032
ZINC000013897362
ZINC000013897365
Check stock
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Check stock on Vitas-MAvailable files
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