Vitas-M small molecule compound
2-methylpropyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-(4-ethoxy-3-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799122
SMILES CCOc1ccc(cc1OC)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC(C)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 C31H34N2O8S MW 594.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H34N2O8S/c1-8-39-22-11-9-20(13-24(22)37-6)14-26-29(35)33-28(21-10-12-23(41-19(5)34)25(15-21)38-7)27(18(4)32-31(33)42-26)30(36)40-16-17(2)3/h9-15,17,28H,8,16H2,1-7H3/b26-14-InChIKey
PKYGDLHQEFGOFW-WGARJPEWSA-NSynonyms
2methylpropyl(2Z)5(4(acetyloxy)3methoxyphenyl)2(4ethoxy3methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
2METHYLPROPYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)2((4ETHOXY3METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC(C)C)C4=CC(=C(C=C4)OC(=O)C)OC)OC
CCOc1ccc(cc1OC)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC(C)C)C
InChI=1SC31H34N2O8Sc18392211920(1324(22)376)142629(35)3328(21101223(4119(5)34)25(1521)387)27(18(4)3231(33)4226)30(36)401617(2)3h9151728H816H217H3b2614
MFCD03462292
ZINC000097946263
ZINC000097946264
Check stock
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Check stock on Vitas-MAvailable files
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