Vitas-M small molecule compound
ethyl (2E)-2-[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK310771
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1cn(nc1C)C)/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 C20H20N4O3S2 MW 428.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3S2/c1-5-27-19(26)16-12(3)21-20-24(17(16)14-7-6-8-28-14)18(25)15(29-20)9-13-10-23(4)22-11(13)2/h6-10,17H,5H2,1-4H3/b15-9+InChIKey
TYSSGPLQBILRDR-OQLLNIDSSA-NSynonyms
1005641-05-31005641053
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cn(nc1C)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CN(N=C4C)C)S2)C
ethyl(2E)2((13dimethyl1Hpyrazol4yl)methylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2((13dimethylpyrazol4yl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC20H20N4O3S2c152719(26)1612(3)212024(17(16)147682814)18(25)15(2920)9131023(4)2211(13)2h61017H5H214H3b159+
MFCD04136417
ZINC000013960147
ZINC000013960148
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