Vitas-M small molecule compound
methyl (2E)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-[(3-phenyl-1H-pyrazol-4-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL396060
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1c[nH]nc1c1ccccc1)/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 C26H22N4O4S MW 486.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O4S/c1-15-21(25(32)34-3)23(17-9-11-19(33-2)12-10-17)30-24(31)20(35-26(30)28-15)13-18-14-27-29-22(18)16-7-5-4-6-8-16/h4-14,23H,1-3H3,(H,27,29)/b20-13+InChIKey
LQUXPDMZKVMBHQ-DEDYPNTBSA-NSynonyms
512810-73-0512810730
CC1=C(C(N2C(=O)C(=CC3=C(NN=C3)C4=CC=CC=C4)SC2=N1)C5=CC=C(C=C5)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1c(nH)nc1c1ccccc1)s2
InChI=1SC26H22N4O4Sc11521(25(32)343)23(1791119(332)121017)3024(31)20(3526(30)2815)131814272922(18)167546816h41423H13H3(H2729)b2013+
METHYL(2E)5(4METHOXYPHENYL)7METHYL3OXO2((3PHENYL1HPYRAZOL4YL)METHYLIDENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)5(4methoxyphenyl)7methyl3oxo2((5phenyl1Hpyrazol4yl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL5(4METHOXYPHENYL)7METHYL3OXO2((3PHENYL1HPYRAZOL4YL)METHYLENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03465956
ZINC000008441766
ZINC000008441768
Check stock
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Check stock on Vitas-MAvailable files
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