Vitas-M small molecule compound
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-[5-bromo-4-(diethylamino)-2-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522655
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1cc(Br)c(cc1OC)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 C29H30BrN3O6S MW 628.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30BrN3O6S/c1-6-32(7-2)20-14-22(36-5)18(11-19(20)30)13-24-27(34)33-26(17-9-10-21-23(12-17)39-15-38-21)25(28(35)37-8-3)16(4)31-29(33)40-24/h9-14,26H,6-8,15H2,1-5H3/b24-13-InChIKey
LLGMWSAJYZKZLM-CFRMEGHHSA-NSynonyms
CCN(CC)C1=C(C=C(C(=C1)OC)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC5=C(C=C4)OCO5)Br
CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)c(=Cc1cc(Br)c(cc1OC)N(CC)CC)s2
ETHYL(2Z)5(13BENZODIOXOL5YL)2((5BROMO4(DIETHYLAMINO)2METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(13benzodioxol5yl)2(5bromo4(diethylamino)2methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC29H30BrN3O6Sc1632(72)201422(365)18(1119(20)30)132427(34)3326(179102123(1217)39153821)25(28(35)3783)16(4)3129(33)4024h91426H6815H215H3b2413
MFCD02189867
ZINC000100618797
ZINC000100618800
Check stock
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Check stock on Vitas-MAvailable files
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