Vitas-M small molecule compound
ethyl (2Z)-2-{4-[(2-chlorobenzyl)oxy]-3-methoxybenzylidene}-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK332258
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)/c(=C/c1ccc(c(c1)OC)OCc1ccccc1Cl)/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 C36H31ClN2O6S MW 655.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H31ClN2O6S/c1-5-44-35(41)31-21(2)38-36-39(33(31)32-25-12-8-6-10-23(25)15-17-28(32)42-3)34(40)30(46-36)19-22-14-16-27(29(18-22)43-4)45-20-24-11-7-9-13-26(24)37/h6-19,33H,5,20H2,1-4H3/b30-19-InChIKey
VMYKQIVMOJJRQN-FSGOGVSDSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1c(OC)ccc3c1cccc3)c(=O)c(=Cc1ccc(c(c1)OC)OCc1ccccc1Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC4=CC=CC=C43)OC)C(=O)C(=CC5=CC(=C(C=C5)OCC6=CC=CC=C6Cl)OC)S2)C
ETHYL(2Z)2((4((2CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)5(2METHOXYNAPHTHALEN1YL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4((2chlorobenzyl)oxy)3methoxybenzylidene)5(2methoxynaphthalen1yl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(4((2CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)5(2METHOXY1NAPHTHYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC36H31ClN2O6Sc154435(41)3121(2)383639(33(31)322512861023(25)151728(32)423)34(40)30(4636)1922141627(29(1822)434)45202411791326(24)37h61933H520H214H3b3019
MFCD01593103
ZINC000008424825
ZINC000008424828
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