Vitas-M small molecule compound
ethyl (2Z)-2-(3-iodo-4,5-dimethoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522624
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1cc(I)c(c(c1)OC)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 C25H23IN2O5S MW 590.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23IN2O5S/c1-5-33-24(30)20-14(2)27-25-28(21(20)16-9-7-6-8-10-16)23(29)19(34-25)13-15-11-17(26)22(32-4)18(12-15)31-3/h6-13,21H,5H2,1-4H3/b19-13-InChIKey
GWQJRZFRSUTFSQ-UYRXBGFRSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cc(I)c(c(c1)OC)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C(=C4)I)OC)OC)S2)C
ethyl(2Z)2((3iodo45dimethoxyphenyl)methylidene)7methyl3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(3iodo45dimethoxybenzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H23IN2O5Sc153324(30)2014(2)272528(21(20)1697681016)23(29)19(3425)13151117(26)22(324)18(1215)313h61321H5H214H3b1913
MFCD02109427
ZINC000100618308
ZINC000100618312
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