Vitas-M small molecule compound
benzyl 8-methyl-4-oxo-6-(3-phenoxyphenyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK812970
SMILES O=C(C1=C(C)N=C2N(C1c1cccc(c1)Oc1ccccc1)C(=O)CCS2)OCc1ccccc1
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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 C28H24N2O4S MW 484.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O4S/c1-19-25(27(32)33-18-20-9-4-2-5-10-20)26(30-24(31)15-16-35-28(30)29-19)21-11-8-14-23(17-21)34-22-12-6-3-7-13-22/h2-14,17,26H,15-16,18H2,1H3InChIKey
BKBHCISYFFWPCL-UHFFFAOYSA-NSynonyms
benzyl8methyl4oxo6(3phenoxyphenyl)34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
BENZYL8METHYL4OXO6(3PHENOXYPHENYL)36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
CC1=C(C(N2C(=O)CCSC2=N1)C3=CC(=CC=C3)OC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5
InChI=1SC28H24N2O4Sc11925(27(32)33182094251020)26(3024(31)15163528(30)2919)211181423(1721)3422126371322h2141726H151618H21H3
MFCD03530047
ZINC000016729347
ZINC000016729350
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