Vitas-M small molecule compound
methyl (2Z)-5-[4-(acetyloxy)phenyl]-2-[4-(diethylamino)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK861944
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/c1ccc(cc1)N(CC)CC)/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 C28H29N3O5S MW 519.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O5S/c1-6-30(7-2)21-12-8-19(9-13-21)16-23-26(33)31-25(20-10-14-22(15-11-20)36-18(4)32)24(27(34)35-5)17(3)29-28(31)37-23/h8-16,25H,6-7H2,1-5H3/b23-16-InChIKey
WAIBQEVJCOVQIR-KQWNVCNZSA-NSynonyms
(E)methyl5(4acetoxyphenyl)2(4(diethylamino)benzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)OC(=O)C
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1ccc(cc1)N(CC)CC)s2
InChI=1SC28H29N3O5Sc1630(72)2112819(91321)162326(33)3125(20101422(151120)3618(4)32)24(27(34)355)17(3)2928(31)3723h81625H67H215H3b2316
methyl(2Z)5(4(acetyloxy)phenyl)2(4(diethylamino)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)5(4ACETYLOXYPHENYL)2((4(DIETHYLAMINO)PHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01794262
ZINC000033924380
ZINC000033924382
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.