Vitas-M small molecule compound
benzyl 6-[4-(methoxycarbonyl)phenyl]-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK811723
SMILES COC(=O)c1ccc(cc1)C1N2C(=O)CCSC2=NC(=C1C(=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 C24H22N2O5S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5S/c1-15-20(23(29)31-14-16-6-4-3-5-7-16)21(26-19(27)12-13-32-24(26)25-15)17-8-10-18(11-9-17)22(28)30-2/h3-11,21H,12-14H2,1-2H3InChIKey
YPYRAALZJQJNFY-UHFFFAOYSA-NSynonyms
608491-16-3608491163
BENZYL(6R)6(4(METHOXYCARBONYL)PHENYL)8METHYL4OXO34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
benzyl6(4(methoxycarbonyl)phenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL6(4METHOXYCARBONYLPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC=C(C=C3)C(=O)OC)C(=O)OCC4=CC=CC=C4
InChI=1SC24H22N2O5Sc11520(23(29)3114166435716)21(2619(27)12133224(26)2515)1781018(11917)22(28)302h31121H1214H212H3
MFCD03530190
ZINC000001129895
ZINC000001129896
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