Vitas-M small molecule compound
(5E)-2-[4-(naphthalen-1-yl)piperazin-1-yl]-5-{2-[(4-nitrobenzyl)oxy]benzylidene}-1,3-thiazol-4(5H)-one
Catalog ID
STK548760
SMILES O=C1N=C(S/C/1=C/c1ccccc1OCc1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)c1cccc2c1cccc2
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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 C31H26N4O4S MW 550.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O4S/c36-30-29(20-24-7-2-4-11-28(24)39-21-22-12-14-25(15-13-22)35(37)38)40-31(32-30)34-18-16-33(17-19-34)27-10-5-8-23-6-1-3-9-26(23)27/h1-15,20H,16-19,21H2/b29-20+InChIKey
SDYOLSXATYXJDD-ZTKZIYFRSA-NSynonyms
(5E)2(4(naphthalen1yl)piperazin1yl)5(2((4nitrobenzyl)oxy)benzylidene)13thiazol4(5H)one
(5E)2(4NAPHTHALEN1YLPIPERAZIN1YL)5((2((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)13THIAZOL4ONE
(E)2(4(naphthalen1yl)piperazin1yl)5(2((4nitrobenzyl)oxy)benzylidene)thiazol4(5H)one
C1CN(CCN1C2=CC=CC3=CC=CC=C32)C4=NC(=O)C(=CC5=CC=CC=C5OCC6=CC=C(C=C6)(N+)(=O)(O))S4
InChI=1SC31H26N4O4Sc363029(20247241128(24)392122121425(151322)35(37)38)4031(3230)34181633(171934)27105823613926(23)27h11520H161921H2b2920+
MFCD03667597
O=C1N=C(SC1=Cc1ccccc1OCc1ccc(cc1)(N+)(=O)(O))N1CCN(CC1)c1cccc2c1cccc2
ZINC000101352275
ZINC101352275
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