Vitas-M small molecule compound
ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-{3-[(2,3-dimethylphenoxy)methyl]-4-methoxybenzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL176452
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)/c(=C\c1ccc(c(c1)COc1cccc(c1C)C)OC)/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 C35H37N3O5S MW 611.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H37N3O5S/c1-8-42-34(40)31-23(4)36-35-38(32(31)25-13-15-27(16-14-25)37(5)6)33(39)30(44-35)19-24-12-17-29(41-7)26(18-24)20-43-28-11-9-10-21(2)22(28)3/h9-19,32H,8,20H2,1-7H3/b30-19+InChIKey
GBZNNVFACASQFC-NDZAJKAJSA-NSynonyms
767633-07-8767633078
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)N(C)C)c(=O)c(=Cc1ccc(c(c1)COc1cccc(c1C)C)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=CC(=C5C)C)S2)C
ethyl(2E)5(4(dimethylamino)phenyl)2((3((23dimethylphenoxy)methyl)4methoxyphenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4(dimethylamino)phenyl)2(3((23dimethylphenoxy)methyl)4methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC35H37N3O5Sc184234(40)3123(4)363538(32(31)25131527(161425)37(5)6)33(39)30(4435)1924121729(417)26(1824)2043281191021(2)22(28)3h91932H820H217H3b3019+
MFCD04048808
ZINC000102441980
ZINC000102441983
Check stock
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Check stock on Vitas-MAvailable files
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