Vitas-M small molecule compound
ethyl (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-5-(4-ethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL484817
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)/c(=C/c1ccc3c(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 C26H24N2O6S MW 492.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O6S/c1-4-31-18-9-7-17(8-10-18)23-22(25(30)32-5-2)15(3)27-26-28(23)24(29)21(35-26)13-16-6-11-19-20(12-16)34-14-33-19/h6-13,23H,4-5,14H2,1-3H3/b21-13-InChIKey
WTCZLBBYCFVWBF-BKUYFWCQSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)c(=Cc1ccc3c(c1)OCO3)s2
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC5=C(C=C4)OCO5)S3)C)C(=O)OCC
ethyl(2Z)2(13benzodioxol5ylmethylidene)5(4ethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)5(4ETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)5(4ETHOXYPHENYL)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H24N2O6Sc1431189717(81018)2322(25(30)3252)15(3)272628(23)24(29)21(3526)13166111920(1216)34143319h61323H4514H213H3b2113
MFCD03547065
ZINC000016691545
ZINC000016691547
Check stock
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Check stock on Vitas-MAvailable files
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