Vitas-M small molecule compound
ethyl (2Z)-2-[4-(1,3-benzodioxol-5-ylmethoxy)-3-ethoxybenzylidene]-5-(2-ethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK104968
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OCC)c(=O)/c(=C/c1ccc(c(c1)OCC)OCc1ccc3c(c1)OCO3)/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 C35H34N2O8S MW 642.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N2O8S/c1-5-40-25-11-9-8-10-24(25)32-31(34(39)42-7-3)21(4)36-35-37(32)33(38)30(46-35)18-22-12-14-26(28(16-22)41-6-2)43-19-23-13-15-27-29(17-23)45-20-44-27/h8-18,32H,5-7,19-20H2,1-4H3/b30-18-InChIKey
QXMMZJYZBMDVLG-YKQZZPSBSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OCC)c(=O)c(=Cc1ccc(c(c1)OCC)OCc1ccc3c(c1)OCO3)s2
CCOC1=CC=CC=C1C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OCC5=CC6=C(C=C5)OCO6)OCC)S3)C)C(=O)OCC
ETHYL(2Z)2((4(13BENZODIOXOL5YLMETHOXY)3ETHOXYPHENYL)METHYLIDENE)5(2ETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(4(13BENZODIOXOL5YLMETHOXY)3ETHOXYBENZYLIDENE)5(2ETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC35H34N2O8Sc15402511981024(25)3231(34(39)4273)21(4)363537(32)33(38)30(4635)1822121426(28(1622)4162)43192313152729(1723)45204427h81832H571920H214H3b3018
MFCD03167907
ZINC000097959525
ZINC000097959526
Check stock
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