Vitas-M small molecule compound

(2E)-5-(4-butylbenzyl)-2-[(2E)-(4-nitrobenzylidene)hydrazinylidene]-1,3-thiazolidin-4-one

Catalog ID
STK731847
SMILES CCCCc1ccc(cc1)CC1S/C(=N/N=C/c2ccc(cc2)[N+](=O)[O-])/NC1=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 C21H22N4O3S MW 410.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O3S/c1-2-3-4-15-5-7-16(8-6-15)13-19-20(26)23-21(29-19)24-22-14-17-9-11-18(12-10-17)25(27)28/h5-12,14,19H,2-4,13H2,1H3,(H,23,24,26)/b22-14+
InChIKey
HFVWKGIHYSVSGS-HYARGMPZSA-N
Synonyms
637322-76-0
(2E)5(4butylbenzyl)2((2E)(4nitrobenzylidene)hydrazinylidene)13thiazolidin4one
(E)5(4butylbenzyl)2((E)(4nitrobenzylidene)hydrazono)thiazolidin4one
2((2E)3(4NITROPHENYL)12DIAZAPROP2ENYLIDENE)5((4BUTYLPHENYL)METHYL)13THIAZOLIDIN4ONE
5((4butylphenyl)methyl)2((2E)2((4nitrophenyl)methylidene)hydrazinyl)13thiazol4one
637322760
CCCCC1=CC=C(C=C1)CC2C(=O)N=C(S2)NN=CC3=CC=C(C=C3)(N+)(=O)(O)
CCCCc1ccc(cc1)CC1SC(=NN=Cc2ccc(cc2)(N+)(=O)(O))NC1=O
InChI=1SC21H22N4O3Sc1234155716(8615)131920(26)2321(2919)2422141791118(121017)25(27)28h5121419H2413H21H3(H232426)b2214+
MFCD04182306
ZINC000005429156
ZINC000005429159

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Available files

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