Vitas-M small molecule compound
(5E)-5-[2-(benzyloxy)benzylidene]-2-[4-(2-nitrophenyl)piperazin-1-yl]-1,3-thiazol-4(5H)-one
Catalog ID
STK538113
SMILES O=C1N=C(S/C/1=C/c1ccccc1OCc1ccccc1)N1CCN(CC1)c1ccccc1[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 C27H24N4O4S MW 500.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N4O4S/c32-26-25(18-21-10-4-7-13-24(21)35-19-20-8-2-1-3-9-20)36-27(28-26)30-16-14-29(15-17-30)22-11-5-6-12-23(22)31(33)34/h1-13,18H,14-17,19H2/b25-18+InChIKey
DWKOMUHVFKNMIM-XIEYBQDHSA-NSynonyms
384356-54-1(5E)2(4(2nitrophenyl)piperazin1yl)5((2phenylmethoxyphenyl)methylidene)13thiazol4one
(5E)5(2(benzyloxy)benzylidene)2(4(2nitrophenyl)piperazin1yl)13thiazol4(5H)one
(E)5(2(benzyloxy)benzylidene)2(4(2nitrophenyl)piperazin1yl)thiazol4(5H)one
384356541
C1CN(CCN1C2=CC=CC=C2(N+)(=O)(O))C3=NC(=O)C(=CC4=CC=CC=C4OCC5=CC=CC=C5)S3
InChI=1SC27H24N4O4Sc322625(182110471324(21)3519208213920)3627(2826)30161429(151730)2211561223(22)31(33)34h11318H141719H2b2518+
MFCD03000898
O=C1N=C(SC1=Cc1ccccc1OCc1ccccc1)N1CCN(CC1)c1ccccc1(N+)(=O)(O)
ZINC000009045219
ZINC09045219
ZINC9045219
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