Vitas-M small molecule compound
(4E)-4-[hydroxy(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-1-[3-(morpholin-4-yl)propyl]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK634704
SMILES O=C1C(=O)N(C(/C/1=C(/c1c(C)nn(c1C)C)\O)c1cccs1)CCCN1CCOCC1
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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 C22H28N4O4S MW 444.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O4S/c1-14-17(15(2)24(3)23-14)20(27)18-19(16-6-4-13-31-16)26(22(29)21(18)28)8-5-7-25-9-11-30-12-10-25/h4,6,13,19,27H,5,7-12H2,1-3H3/b20-18+InChIKey
VYVSYGUCFFQLNG-CZIZESTLSA-NSynonyms
1010863-53-2(4E)4(hydroxy(135trimethyl1Hpyrazol4yl)methylidene)1(3(morpholin4yl)propyl)5(thiophen2yl)pyrrolidine23dione
(4E)4(hydroxy(135trimethylpyrazol4yl)methylidene)1(3morpholin4ylpropyl)5thiophen2ylpyrrolidine23dione
1010863532
CC1=C(C(=NN1C)C)C(=C2C(N(C(=O)C2=O)CCCN3CCOCC3)C4=CC=CS4)O
InChI=1SC22H28N4O4Sc11417(15(2)24(3)2314)20(27)1819(1664133116)26(22(29)21(18)28)8572591130121025h46131927H5712H213H3b2018+
MFCD18160479
O=C1C(=O)N(C(C1=C(c1c(C)nn(c1C)C)O)c1cccs1)CCCN1CCOCC1
ZINC000102738671
ZINC000102738674
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