Vitas-M small molecule compound
benzyl 8-methyl-4-oxo-6-[4-(prop-2-en-1-yloxy)phenyl]-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK815776
SMILES C=CCOc1ccc(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 C25H24N2O4S MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O4S/c1-3-14-30-20-11-9-19(10-12-20)23-22(24(29)31-16-18-7-5-4-6-8-18)17(2)26-25-27(23)21(28)13-15-32-25/h3-12,23H,1,13-16H2,2H3InChIKey
ZXIJWCJCXDKWOZ-UHFFFAOYSA-NSynonyms
benzyl8methyl4oxo6(4(prop2en1yloxy)phenyl)34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL8METHYL4OXO6(4PROP2ENOXYPHENYL)36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC=C(C=C3)OCC=C)C(=O)OCC4=CC=CC=C4
InChI=1SC25H24N2O4Sc1314302011919(101220)2322(24(29)3116187546818)17(2)262527(23)21(28)13153225h31223H11316H22H3
MFCD03530130
ZINC000002487008
ZINC000002487010
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