Vitas-M small molecule compound
ethyl (2Z)-2-(3-bromo-4-methoxybenzylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL412140
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(c(c1)Br)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 C24H21BrN2O4S MW 513.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN2O4S/c1-4-31-23(29)20-14(2)26-24-27(21(20)16-8-6-5-7-9-16)22(28)19(32-24)13-15-10-11-18(30-3)17(25)12-15/h5-13,21H,4H2,1-3H3/b19-13-InChIKey
HZHULAXBXMRUPL-UYRXBGFRSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(c(c1)Br)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC(=C(C=C4)OC)Br)S2)C
ETHYL(2Z)2((3BROMO4METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3bromo4methoxybenzylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC24H21BrN2O4Sc143123(29)2014(2)262427(21(20)168657916)22(28)19(3224)1315101118(303)17(25)1215h51321H4H213H3b1913
MFCD01061649
ZINC000002916736
ZINC000002916740
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