Vitas-M small molecule compound
methyl 2-[1-(4-ethylphenyl)-7-methyl-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK515292
SMILES COC(=O)c1sc(nc1C)N1C(=O)c2c(C1c1ccc(cc1)CC)c(=O)c1c(o2)ccc(c1)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 C26H22N2O5S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O5S/c1-5-15-7-9-16(10-8-15)20-19-21(29)17-12-13(2)6-11-18(17)33-22(19)24(30)28(20)26-27-14(3)23(34-26)25(31)32-4/h6-12,20H,5H2,1-4H3InChIKey
DWNQGUGCMIDRJK-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)C2C3=C(C(=O)N2C4=NC(=C(S4)C(=O)OC)C)OC5=C(C3=O)C=C(C=C5)C
InChI=1SC26H22N2O5Sc15157916(10815)201921(29)171213(2)61118(17)3322(19)24(30)28(20)262714(3)23(3426)25(31)324h61220H5H214H3
methyl2(1(4ethylphenyl)7methyl39dioxo1Hchromeno(23c)pyrrol2yl)4methyl13thiazole5carboxylate
methyl2(1(4ethylphenyl)7methyl39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
MFCD06645192
ZINC000016741733
ZINC000016741734
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