Vitas-M small molecule compound
benzyl 6-(3,4-dichlorophenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK812960
SMILES O=C1CCSC2=NC(=C(C(N12)c1ccc(c(c1)Cl)Cl)C(=O)OCc1ccccc1)C
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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 C22H18Cl2N2O3S MW 461.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl2N2O3S/c1-13-19(21(28)29-12-14-5-3-2-4-6-14)20(15-7-8-16(23)17(24)11-15)26-18(27)9-10-30-22(26)25-13/h2-8,11,20H,9-10,12H2,1H3InChIKey
PGUCAPWWZHVVBI-UHFFFAOYSA-NSynonyms
benzyl6(34dichlorophenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL6(34DICHLOROPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC(=C(C=C3)Cl)Cl)C(=O)OCC4=CC=CC=C4
InChI=1SC22H18Cl2N2O3Sc11319(21(28)2912145324614)20(157816(23)17(24)1115)2618(27)9103022(26)2513h281120H91012H21H3
MFCD03530035
ZINC000016729335
ZINC000016729338
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