Vitas-M small molecule compound
(4E)-1-[3-(dimethylamino)propyl]-4-[hydroxy(1,3,5-trimethyl-1H-pyrazol-4-yl)methylidene]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK635872
SMILES CN(CCCN1C(=O)C(=O)/C(=C(\c2c(C)nn(c2C)C)/O)/C1c1cccs1)C
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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 C20H26N4O3S MW 402.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O3S/c1-12-15(13(2)23(5)21-12)18(25)16-17(14-8-6-11-28-14)24(20(27)19(16)26)10-7-9-22(3)4/h6,8,11,17,25H,7,9-10H2,1-5H3/b18-16+InChIKey
VLSOWNSQRRVADR-FBMGVBCBSA-NSynonyms
1010866-96-2(4E)1(3(dimethylamino)propyl)4(hydroxy(135trimethyl1Hpyrazol4yl)methylidene)5(thiophen2yl)pyrrolidine23dione
(4E)1(3(dimethylamino)propyl)4(hydroxy(135trimethylpyrazol4yl)methylidene)5thiophen2ylpyrrolidine23dione
1010866962
CC1=C(C(=NN1C)C)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC=CS3)O
CN(CCCN1C(=O)C(=O)C(=C(c2c(C)nn(c2C)C)O)C1c1cccs1)C
InChI=1SC20H26N4O3Sc11215(13(2)23(5)2112)18(25)1617(1486112814)24(20(27)19(16)26)107922(3)4h68111725H7910H215H3b1816+
MFCD18160876
ZINC000102742024
ZINC000102742029
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