Vitas-M small molecule compound
ethyl (2E)-2-[(5-bromothiophen-2-yl)methylidene]-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL407036
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C\c1ccc(s1)Br)/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 C24H23BrN2O3S2 MW 531.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23BrN2O3S2/c1-5-30-23(29)20-14(4)26-24-27(21(20)16-8-6-15(7-9-16)13(2)3)22(28)18(32-24)12-17-10-11-19(25)31-17/h6-13,21H,5H2,1-4H3/b18-12+InChIKey
YDMNCDILLBCXKH-LDADJPATSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(s1)Br)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)C)C(=O)C(=CC4=CC=C(S4)Br)S2)C
ethyl(2E)2((5bromothiophen2yl)methylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2((5bromothiophen2yl)methylidene)7methyl3oxo5(4propan2ylphenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC24H23BrN2O3S2c153023(29)2014(4)262427(21(20)168615(7916)13(2)3)22(28)18(3224)1217101119(25)3117h61321H5H214H3b1812+
MFCD07576962
ZINC000103790094
ZINC000103790097
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