Vitas-M small molecule compound
(5E)-2-(4-acetylpiperazin-1-yl)-5-(4-hydroxy-3-nitrobenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STK540790
SMILES CC(=O)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(c(c2)[N+](=O)[O-])O)/S1
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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 C16H16N4O5S MW 376.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O5S/c1-10(21)18-4-6-19(7-5-18)16-17-15(23)14(26-16)9-11-2-3-13(22)12(8-11)20(24)25/h2-3,8-9,22H,4-7H2,1H3/b14-9+InChIKey
YZGRSOYFBGDOSF-NTEUORMPSA-NSynonyms
371139-05-8(5E)2(4ACETYLPIPERAZIN1YL)5((4HYDROXY3NITROPHENYL)METHYLIDENE)13THIAZOL4ONE
(5E)2(4acetylpiperazin1yl)5(4hydroxy3nitrobenzylidene)13thiazol4(5H)one
(E)2(4acetylpiperazin1yl)5(4hydroxy3nitrobenzylidene)thiazol4(5H)one
371139058
CC(=O)N1CCN(CC1)C1=NC(=O)C(=Cc2ccc(c(c2)(N+)(=O)(O))O)S1
CC(=O)N1CCN(CC1)C2=NC(=O)C(=CC3=CC(=C(C=C3)O)(N+)(=O)(O))S2
InChI=1SC16H16N4O5Sc110(21)184619(7518)161715(23)14(2616)9112313(22)12(811)20(24)25h238922H47H21H3b149+
MFCD03008837
ZINC000012379400
ZINC12379400
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