Vitas-M small molecule compound
methyl [7-(4,7-dimethoxy-1,3-benzodioxol-5-yl)-4-(3-methoxyphenyl)-2,5-dioxo-4,5,6,7-tetrahydro[1,3]thiazolo[4,5-b]pyridin-3(2H)-yl]acetate
Catalog ID
STL433474
SMILES COc1cccc(c1)N1C(=O)CC(c2c1n(CC(=O)OC)c(=O)s2)c1cc(OC)c2c(c1OC)OCO2
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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 C25H24N2O9S MW 528.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O9S/c1-31-14-7-5-6-13(8-14)27-18(28)10-16(23-24(27)26(25(30)37-23)11-19(29)33-3)15-9-17(32-2)21-22(20(15)34-4)36-12-35-21/h5-9,16H,10-12H2,1-4H3InChIKey
BGTUEFJLNAFAQF-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1)N2C(=O)CC(C3=C2N(C(=O)S3)CC(=O)OC)C4=CC(=C5C(=C4OC)OCO5)OC
InChI=1SC25H24N2O9Sc1311475613(814)2718(28)1016(2324(27)26(25(30)3723)1119(29)333)15917(322)2122(20(15)344)36123521h5916H1012H214H3
methyl(7(47dimethoxy13benzodioxol5yl)4(3methoxyphenyl)25dioxo4567tetrahydro(13)thiazolo(45b)pyridin3(2H)yl)acetate
methyl2(7(47dimethoxy13benzodioxol5yl)4(3methoxyphenyl)25dioxo67dihydro(13)thiazolo(45b)pyridin3yl)acetate
MFCD25975876
ZINC000100251172
ZINC000100251174
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