Vitas-M small molecule compound
ethyl (2Z)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL507211
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc3c(c1)OCCO3)/s2
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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 C23H20N2O5S2 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O5S2/c1-3-28-22(27)19-13(2)24-23-25(20(19)17-5-4-10-31-17)21(26)18(32-23)12-14-6-7-15-16(11-14)30-9-8-29-15/h4-7,10-12,20H,3,8-9H2,1-2H3/b18-12-InChIKey
ASDXSYUHAXXSBZ-PDGQHHTCSA-NSynonyms
6292338
ethyl(2~(Z))2(23dihydro14benzodioxin6ylmethylidene)7methyl3oxo5thiophen2yl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(23dihydro14benzodioxin6ylmethylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(23DIHYDRO14BENZODIOXIN6YLMETHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(23DIHYDRO14BENZODIOXIN6YLMETHYLENE)7METHYL3OXO5(2THIENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H20N2O5S2c132822(27)1913(2)242325(20(19)1754103117)21(26)18(3223)1214671516(1114)30982915h47101220H389H212H3b1812
MFCD03785078
ZINC000000687959
ZINC000000687961
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