Vitas-M small molecule compound

5-[(pentyloxy)methyl]-3-{(2E)-2-[2-(4-phenyl-1,3-thiazol-2-yl)hydrazinylidene]propyl}dihydrofuran-2(3H)-one (non-preferred name)

Catalog ID
STK835104
SMILES CCCCCOCC1CC(C(=O)O1)C/C(=N/Nc1scc(n1)c1ccccc1)/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 C22H29N3O3S MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O3S/c1-3-4-8-11-27-14-19-13-18(21(26)28-19)12-16(2)24-25-22-23-20(15-29-22)17-9-6-5-7-10-17/h5-7,9-10,15,18-19H,3-4,8,11-14H2,1-2H3,(H,23,25)/b24-16+
InChIKey
DVUVPUFNMDMYJB-LFVJCYFKSA-N
Synonyms

(E)5((pentyloxy)methyl)3(2(2(4phenylthiazol2yl)hydrazono)propyl)dihydrofuran2(3H)onehydrobromide
3((2E)2METHYL3((4PHENYL(13THIAZOL2YL))AMINO)3AZAPROP2ENYL)5(PENTYLOXYMETHYL)345TRIHYDROFURAN2ONE
5((pentyloxy)methyl)3((2E)2(2(4phenyl13thiazol2yl)hydrazinylidene)propyl)dihydrofuran2(3H)one(nonpreferredname)
5(pentoxymethyl)3((2E)2((4phenyl13thiazol2yl)hydrazinylidene)propyl)oxolan2one
CCCCCOCC1CC(C(=O)O1)CC(=NNc1scc(n1)c1ccccc1)C
CCCCCOCC1CC(C(=O)O1)CC(=NNc1scc(n1)c1ccccc1)CBr
CCCCCOCC1CC(C(=O)O1)CC(=NNC2=NC(=CS2)C3=CC=CC=C3)C
InChI=1SC22H29N3O3Sc1348112714191318(21(26)2819)1216(2)2425222320(152922)1796571017h57910151819H3481114H212H3(H2325)b2416+
MFCD00698026
ZINC000004610526
ZINC000004610531

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.