Vitas-M small molecule compound
methyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798134
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1ccc(o1)c1ccc(c(c1)Cl)Cl)/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 C29H22Cl2N2O7S MW 613.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N2O7S/c1-14-25(28(36)38-4)26(17-6-9-22(39-15(2)34)23(12-17)37-3)33-27(35)24(41-29(33)32-14)13-18-7-10-21(40-18)16-5-8-19(30)20(31)11-16/h5-13,26H,1-4H3/b24-13+InChIKey
JDJXKZMORVQQAT-ZMOGYAJESA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)Cl)Cl)SC2=N1)C5=CC(=C(C=C5)OC(=O)C)OC)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1ccc(o1)c1ccc(c(c1)Cl)Cl)s2
InChI=1SC29H22Cl2N2O7Sc11425(28(36)384)26(176922(3915(2)34)23(1217)373)3327(35)24(4129(33)3214)131871021(4018)165819(30)20(31)1116h51326H14H3b2413+
methyl(2E)5(4(acetyloxy)3methoxyphenyl)2((5(34dichlorophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4acetyloxy3methoxyphenyl)2((5(34dichlorophenyl)furan2yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417548
ZINC000100838306
ZINC000100838307
Check stock
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Check stock on Vitas-MAvailable files
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