Vitas-M small molecule compound

(5Z)-5-{4-[(4-nitrobenzyl)oxy]benzylidene}-2-[4-(4-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one

Catalog ID
STK568601
SMILES O=C1N=C(S/C/1=C\c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1ccc(cc1)[N+](=O)[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 C27H23N5O6S MW 545.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N5O6S/c33-26-25(17-19-3-11-24(12-4-19)38-18-20-1-5-22(6-2-20)31(34)35)39-27(28-26)30-15-13-29(14-16-30)21-7-9-23(10-8-21)32(36)37/h1-12,17H,13-16,18H2/b25-17-
InChIKey
JUFMDUXDHCPEGL-UQQQWYQISA-N
Synonyms
714918-29-3
(5Z)5((4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)2(4(4NITROPHENYL)PIPERAZIN1YL)13THIAZOL4ONE
(5Z)5(4((4nitrobenzyl)oxy)benzylidene)2(4(4nitrophenyl)piperazin1yl)13thiazol4(5H)one
(Z)5(4((4nitrobenzyl)oxy)benzylidene)2(4(4nitrophenyl)piperazin1yl)thiazol4(5H)one
714918293
C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C3=NC(=O)C(=CC4=CC=C(C=C4)OCC5=CC=C(C=C5)(N+)(=O)(O))S3
InChI=1SC27H23N5O6Sc332625(171931124(12419)3818201522(6220)31(34)35)3927(2826)30151329(141630)217923(10821)32(36)37h11217H131618H2b2517
MFCD05693081
O=C1N=C(SC1=Cc1ccc(cc1)OCc1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000101224908
ZINC101224908

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Available files

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