Vitas-M small molecule compound
(4E)-1-[3-(dimethylamino)propyl]-4-[(3-fluoro-4-methoxyphenyl)(hydroxy)methylidene]-5-(thiophen-2-yl)pyrrolidine-2,3-dione
Catalog ID
STK646542
SMILES COc1ccc(cc1F)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)CCCN(C)C)/O
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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 C21H23FN2O4S MW 418.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23FN2O4S/c1-23(2)9-5-10-24-18(16-6-4-11-29-16)17(20(26)21(24)27)19(25)13-7-8-15(28-3)14(22)12-13/h4,6-8,11-12,18,25H,5,9-10H2,1-3H3/b19-17+InChIKey
XALQKVCBITZMGS-HTXNQAPBSA-NSynonyms
951942-48-6(4E)1(3(dimethylamino)propyl)4((3fluoro4methoxyphenyl)(hydroxy)methylidene)5(thiophen2yl)pyrrolidine23dione
(4E)1(3(dimethylamino)propyl)4((3fluoro4methoxyphenyl)hydroxymethylidene)5thiophen2ylpyrrolidine23dione
951942486
CN(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)F)O)C(=O)C1=O)C3=CC=CS3
COc1ccc(cc1F)C(=C1C(=O)C(=O)N(C1c1cccs1)CCCN(C)C)O
InChI=1SC21H23FN2O4Sc123(2)95102418(1664112916)17(20(26)21(24)27)19(25)137815(283)14(22)1213h46811121825H5910H213H3b1917+
MFCD09798573
ZINC000102754654
ZINC000102754657
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