Vitas-M small molecule compound
ethyl (2Z)-5-(2-ethoxy-3-methoxyphenyl)-2-{3-methoxy-4-[(2,4,6-trimethylbenzyl)oxy]benzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK108270
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)/c(=C/c1ccc(c(c1)OC)OCc1c(C)cc(cc1C)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 C37H40N2O7S MW 656.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H40N2O7S/c1-9-44-34-26(12-11-13-29(34)42-7)33-32(36(41)45-10-2)24(6)38-37-39(33)35(40)31(47-37)19-25-14-15-28(30(18-25)43-8)46-20-27-22(4)16-21(3)17-23(27)5/h11-19,33H,9-10,20H2,1-8H3/b31-19-InChIKey
UEQBTVJRMKLUPZ-DXJNIWACSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)c(=Cc1ccc(c(c1)OC)OCc1c(C)cc(cc1C)C)s2
CCOC1=C(C=CC=C1OC)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OCC5=C(C=C(C=C5C)C)C)OC)S3)C)C(=O)OCC
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)2((3METHOXY4((246TRIMETHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)2(3METHOXY4((246TRIMETHYLBENZYL)OXY)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC37H40N2O7Sc19443426(12111329(34)427)3332(36(41)45102)24(6)383739(33)35(40)31(4737)1925141528(30(1825)438)46202722(4)1621(3)1723(27)5h111933H91020H218H3b3119
MFCD03159018
ZINC000097959558
ZINC000097959559
Check stock
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Check stock on Vitas-MAvailable files
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