Vitas-M small molecule compound
benzyl 6-(4-tert-butylphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK812416
SMILES O=C1CCSC2=NC(=C(C(N12)c1ccc(cc1)C(C)(C)C)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 C26H28N2O3S MW 448.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O3S/c1-17-22(24(30)31-16-18-8-6-5-7-9-18)23(28-21(29)14-15-32-25(28)27-17)19-10-12-20(13-11-19)26(2,3)4/h5-13,23H,14-16H2,1-4H3InChIKey
GSQAXZAJAWRJSG-UHFFFAOYSA-NSynonyms
BENZYL6(4TERTBUTYLPHENYL)8METHYL4OXO2H3H4H6HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
benzyl6(4tertbutylphenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL6(4TERTBUTYLPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC=C(C=C3)C(C)(C)C)C(=O)OCC4=CC=CC=C4
InChI=1SC26H28N2O3Sc11722(24(30)3116188657918)23(2821(29)14153225(28)2717)19101220(131119)26(23)4h51323H1416H214H3
MFCD03529957
ZINC000003636402
ZINC000003636405
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