Vitas-M small molecule compound
(4E)-4-[hydroxy(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-(pyridin-3-ylmethyl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK646346
SMILES O=C1C(=O)N(C(/C/1=C(/c1c(C)nn(c1C)C)\O)c1cccs1)Cc1cccnc1
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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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-12-16(13(2)24(3)23-12)19(26)17-18(15-7-5-9-29-15)25(21(28)20(17)27)11-14-6-4-8-22-10-14/h4-10,18,26H,11H2,1-3H3/b19-17+InChIKey
DPILDOAYPHSHQE-HTXNQAPBSA-NSynonyms
1170448-87-9(4E)4(hydroxy(135trimethyl1Hpyrazol4yl)methylidene)1(pyridin3ylmethyl)5(thiophen2yl)pyrrolidine23dione
(4E)4(hydroxy(135trimethylpyrazol4yl)methylidene)1(pyridin3ylmethyl)5thiophen2ylpyrrolidine23dione
1170448879
CC1=C(C(=NN1C)C)C(=C2C(N(C(=O)C2=O)CC3=CN=CC=C3)C4=CC=CS4)O
InChI=1SC21H20N4O3Sc11216(13(2)24(3)2312)19(26)1718(157592915)25(21(28)20(17)27)1114648221014h4101826H11H213H3b1917+
MFCD18164217
O=C1C(=O)N(C(C1=C(c1c(C)nn(c1C)C)O)c1cccs1)Cc1cccnc1
ZINC000102752793
ZINC000102752795
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