Vitas-M small molecule compound
2-methylpropyl 6-[4-(acetyloxy)-3-ethoxyphenyl]-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK811649
SMILES CCOc1cc(ccc1OC(=O)C)C1N2C(=O)CCSC2=NC(=C1C(=O)OCC(C)C)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 C23H28N2O6S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O6S/c1-6-29-18-11-16(7-8-17(18)31-15(5)26)21-20(22(28)30-12-13(2)3)14(4)24-23-25(21)19(27)9-10-32-23/h7-8,11,13,21H,6,9-10,12H2,1-5H3InChIKey
VKTHJWAZRFEPNB-UHFFFAOYSA-NSynonyms
2methylpropyl6(4(acetyloxy)3ethoxyphenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
2METHYLPROPYL6(4ACETYLOXY3ETHOXYPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OCC(C)C)OC(=O)C
InChI=1SC23H28N2O6Sc1629181116(7817(18)3115(5)26)2120(22(28)301213(2)3)14(4)242325(21)19(27)9103223h78111321H691012H215H3
ISOBUTYL6(4(ACETYLOXY)3ETHOXYPHENYL)8METHYL4OXO34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
MFCD03530090
ZINC000000730322
ZINC000000730323
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