Vitas-M small molecule compound
benzyl (2E)-2-benzylidene-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798463
SMILES O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1ccccc1)/s2)OCc1ccccc1
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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 C26H20N2O3S2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O3S2/c1-17-22(25(30)31-16-19-11-6-3-7-12-19)23(20-13-8-14-32-20)28-24(29)21(33-26(28)27-17)15-18-9-4-2-5-10-18/h2-15,23H,16H2,1H3/b21-15+InChIKey
HWAQESMXKMAFPC-RCCKNPSSSA-NSynonyms
benzyl(2E)2benzylidene7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
benzyl(2E)2benzylidene7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3)SC2=N1)C4=CC=CS4)C(=O)OCC5=CC=CC=C5
InChI=1SC26H20N2O3S2c11722(25(30)311619116371219)23(20138143220)2824(29)21(3326(28)2717)151894251018h21523H16H21H3b2115+
MFCD03417702
O=C(C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1ccccc1)s2)OCc1ccccc1
ZINC000016700316
ZINC000016700318
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