Vitas-M small molecule compound
ethyl (2E)-2-[(1,5-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
STK310708
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\c1cnn(c1C)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)16-11(2)22-20-24(17(16)14-7-6-8-28-14)18(25)15(29-20)9-13-10-21-23(4)12(13)3/h6-10,17H,5H2,1-4H3/b15-9+InChIKey
RMJKSYBDSCQGBI-OQLLNIDSSA-NSynonyms
1005691-49-51005691495
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cnn(c1C)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=C(N(N=C4)C)C)S2)C
ethyl(2E)2((15dimethyl1Hpyrazol4yl)methylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2((15dimethylpyrazol4yl)methylidene)7methyl3oxo5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC20H20N4O3S2c152719(26)1611(2)222024(17(16)147682814)18(25)15(2920)913102123(4)12(13)3h61017H5H214H3b159+
MFCD04136250
ZINC000013960142
ZINC000013960143
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