Vitas-M small molecule compound
prop-2-en-1-yl 6-[4-(acetyloxy)-3-methoxyphenyl]-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK816993
SMILES C=CCOC(=O)C1=C(C)N=C2N(C1c1ccc(c(c1)OC)OC(=O)C)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 C21H22N2O6S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6S/c1-5-9-28-20(26)18-12(2)22-21-23(17(25)8-10-30-21)19(18)14-6-7-15(29-13(3)24)16(11-14)27-4/h5-7,11,19H,1,8-10H2,2-4H3InChIKey
PTVKZFJGQGPUGM-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)OCC=C
InChI=1SC21H22N2O6Sc1592820(26)1812(2)222123(17(25)8103021)19(18)146715(2913(3)24)16(1114)274h571119H1810H224H3
MFCD04526322
prop2en1yl6(4(acetyloxy)3methoxyphenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
PROP2ENYL6(4ACETYLOXY3METHOXYPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
ZINC000003636378
ZINC000003636380
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