Vitas-M small molecule compound

ethyl 2-[1-(4-methoxyphenyl)-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate

Catalog ID
STK818883
SMILES CCOC(=O)c1sc(nc1C)N1C(=O)c2c(C1c1ccc(cc1)OC)c(=O)c1c(o2)cccc1

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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 C25H20N2O6S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O6S/c1-4-32-24(30)22-13(2)26-25(34-22)27-19(14-9-11-15(31-3)12-10-14)18-20(28)16-7-5-6-8-17(16)33-21(18)23(27)29/h5-12,19H,4H2,1-3H3
InChIKey
FDEREWIGMNVKHB-UHFFFAOYSA-N
Synonyms
620587-09-9
620587099
CCOC(=O)C1=C(N=C(S1)N2C(C3=C(C2=O)OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)OC)C
ETHYL2((1R)1(4METHOXYPHENYL)39DIOXO39DIHYDROCHROMENO(23C)PYRROL2(1H)YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2((1S)1(4METHOXYPHENYL)39DIOXO39DIHYDROCHROMENO(23C)PYRROL2(1H)YL)4METHYL13THIAZOLE5CARBOXYLATE
ETHYL2(1(4METHOXYPHENYL)39DIOXO1HCHROMENO(23C)PYRROL2YL)4METHYL13THIAZOLE5CARBOXYLATE
ethyl2(1(4methoxyphenyl)39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
InChI=1SC25H20N2O6Sc143224(30)2213(2)2625(3422)2719(1491115(313)121014)1820(28)16756817(16)3321(18)23(27)29h51219H4H213H3
MFCD05155332
ZINC000001020443
ZINC000001020444

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.