Vitas-M small molecule compound
prop-2-en-1-yl (2E)-2-[2,4-bis(acetyloxy)benzylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK702933
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(cc1OC(=O)C)OC(=O)C)/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 C30H28N2O9S MW 592.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O9S/c1-7-12-39-29(36)26-16(2)31-30-32(27(26)20-9-11-22(37-5)24(13-20)38-6)28(35)25(42-30)14-19-8-10-21(40-17(3)33)15-23(19)41-18(4)34/h7-11,13-15,27H,1,12H2,2-6H3/b25-14+InChIKey
IZWFEXRPBFRDPI-AFUMVMLFSA-NSynonyms
(Z)4((6((allyloxy)carbonyl)5(34dimethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidin2ylidene)methyl)13phenylenediacetate
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1OC(=O)C)OC(=O)C)s2
CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)OC(=O)C)OC(=O)C)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OCC=C
InChI=1SC30H28N2O9Sc17123929(36)2616(2)313032(27(26)2091122(375)24(1320)386)28(35)25(4230)141981021(4017(3)33)1523(19)4118(4)34h711131527H112H226H3b2514+
MFCD03417177
prop2en1yl(2E)2(24bis(acetyloxy)benzylidene)5(34dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
prop2enyl(2E)2((24diacetyloxyphenyl)methylidene)5(34dimethoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000100837917
ZINC000100837919
Check stock
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Check stock on Vitas-MAvailable files
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