Vitas-M small molecule compound
benzyl 6-(4-ethoxy-3-methoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK814741
SMILES CCOc1ccc(cc1OC)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 C25H26N2O5S MW 466.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O5S/c1-4-31-19-11-10-18(14-20(19)30-3)23-22(24(29)32-15-17-8-6-5-7-9-17)16(2)26-25-27(23)21(28)12-13-33-25/h5-11,14,23H,4,12-13,15H2,1-3H3InChIKey
KXXCIHLICUUURY-UHFFFAOYSA-NSynonyms
618080-37-8618080378
benzyl6(4ethoxy3methoxyphenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL6(4ETHOXY3METHOXYPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OCC4=CC=CC=C4)OC
InChI=1SC25H26N2O5Sc143119111018(1420(19)303)2322(24(29)3215178657917)16(2)262527(23)21(28)12133325h5111423H4121315H213H3
MFCD03530054
ZINC000000702618
ZINC000000702619
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