Vitas-M small molecule compound
prop-2-en-1-yl 2-[7-fluoro-1-(4-methylphenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK516248
SMILES C=CCOC(=O)c1sc(nc1C)N1C(=O)c2c(C1c1ccc(cc1)C)c(=O)c1c(o2)ccc(c1)F
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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 C26H19FN2O5S MW 490.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN2O5S/c1-4-11-33-25(32)23-14(3)28-26(35-23)29-20(15-7-5-13(2)6-8-15)19-21(30)17-12-16(27)9-10-18(17)34-22(19)24(29)31/h4-10,12,20H,1,11H2,2-3H3InChIKey
IVRMJJZNIMPQPZ-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2C3=C(C(=O)N2C4=NC(=C(S4)C(=O)OCC=C)C)OC5=C(C3=O)C=C(C=C5)F
InChI=1SC26H19FN2O5Sc14113325(32)2314(3)2826(3523)2920(157513(2)6815)1921(30)171216(27)91018(17)3422(19)24(29)31h4101220H111H223H3
MFCD06645572
prop2en1yl2(7fluoro1(4methylphenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
prop2enyl2(7fluoro1(4methylphenyl)39dioxo1Hchromeno(23c)pyrrol2yl)4methyl13thiazole5carboxylate
ZINC000016742253
ZINC000016742254
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