Vitas-M small molecule compound
ethyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK809510
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1ccc(o1)c1ccc(cc1)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 C30H25ClN2O7S MW 593.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN2O7S/c1-5-38-29(36)26-16(2)32-30-33(27(26)19-8-12-23(39-17(3)34)24(14-19)37-4)28(35)25(41-30)15-21-11-13-22(40-21)18-6-9-20(31)10-7-18/h6-15,27H,5H2,1-4H3/b25-15+InChIKey
SMPKBDMCYXZAQB-MFKUBSTISA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1ccc(o1)c1ccc(cc1)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)Cl)S2)C
ethyl(2E)5(4(acetyloxy)3methoxyphenyl)2((5(4chlorophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3methoxyphenyl)2((5(4chlorophenyl)furan2yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC30H25ClN2O7Sc153829(36)2616(2)323033(27(26)1981223(3917(3)34)24(1419)374)28(35)25(4130)1521111322(4021)186920(31)10718h61527H5H214H3b2515+
MFCD01162927
ZINC000097946052
ZINC000097946054
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.