Vitas-M small molecule compound
methyl 6-(1,3-diphenyl-1H-pyrazol-4-yl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK821611
SMILES COC(=O)C1=C(C)N=C2N(C1c1cn(nc1c1ccccc1)c1ccccc1)C(=O)CCS2
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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 C25H22N4O3S MW 458.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3S/c1-16-21(24(31)32-2)23(29-20(30)13-14-33-25(29)26-16)19-15-28(18-11-7-4-8-12-18)27-22(19)17-9-5-3-6-10-17/h3-12,15,23H,13-14H2,1-2H3InChIKey
KFYRUBGIIJBCJP-UHFFFAOYSA-NSynonyms
1017596-30-31017596303
CC1=C(C(N2C(=O)CCSC2=N1)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC
InChI=1SC25H22N4O3Sc11621(24(31)322)23(2920(30)13143325(29)2616)191528(18117481218)2722(19)1795361017h3121523H1314H212H3
methyl6(13diphenyl1Hpyrazol4yl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
methyl6(13diphenylpyrazol4yl)8methyl4oxo36dihydro2Hpyrimido(21b)(13)thiazine7carboxylate
MFCD03462895
ZINC000026687985
ZINC000026687990
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