Vitas-M small molecule compound
methyl 2-[1-(3-hydroxyphenyl)-6,7-dimethyl-3,9-dioxo-3,9-dihydrochromeno[2,3-c]pyrrol-2(1H)-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK515419
SMILES COC(=O)c1sc(nc1C)N1C(c2cccc(c2)O)c2c(C1=O)oc1c(c2=O)cc(c(c1)C)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 C25H20N2O6S MW 476.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O6S/c1-11-8-16-17(9-12(11)2)33-21-18(20(16)29)19(14-6-5-7-15(28)10-14)27(23(21)30)25-26-13(3)22(34-25)24(31)32-4/h5-10,19,28H,1-4H3InChIKey
RIBCGEZUFNHVBY-UHFFFAOYSA-NSynonyms
890014-67-2890014672
CC1=C(C=C2C(=C1)C(=O)C3=C(O2)C(=O)N(C3C4=CC(=CC=C4)O)C5=NC(=C(S5)C(=O)OC)C)C
InChI=1SC25H20N2O6Sc11181617(912(11)2)332118(20(16)29)19(1465715(28)1014)27(23(21)30)252613(3)22(3425)24(31)324h5101928H14H3
methyl2(1(3hydroxyphenyl)67dimethyl39dioxo1Hchromeno(23c)pyrrol2yl)4methyl13thiazole5carboxylate
methyl2(1(3hydroxyphenyl)67dimethyl39dioxo39dihydrochromeno(23c)pyrrol2(1H)yl)4methyl13thiazole5carboxylate
MFCD06645247
ZINC000016741874
ZINC000016741875
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