Vitas-M small molecule compound
(4Z)-2-(ethylsulfanyl)-4-(2-methoxy-5-nitrobenzylidene)-1,3-thiazol-5(4H)-one
Catalog ID
STK509394
SMILES [O-][N+](=O)c1cc(/C=C/2\N=C(SC2=O)SCC)c(cc1)OC
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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 C13H12N2O4S2 MW 324.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N2O4S2/c1-3-20-13-14-10(12(16)21-13)7-8-6-9(15(17)18)4-5-11(8)19-2/h4-7H,3H2,1-2H3/b10-7-InChIKey
OKBPBYVMBICBNT-YFHOEESVSA-NSynonyms
(4Z)2(ethylsulfanyl)4(2methoxy5nitrobenzylidene)13thiazol5(4H)one
(4Z)2ETHYLSULFANYL4((2METHOXY5NITROPHENYL)METHYLIDENE)13THIAZOL5ONE
(O)(N+)(=O)c1cc(C=C2N=C(SC2=O)SCC)c(cc1)OC
CCSC1=NC(=CC2=C(C=CC(=C2)(N+)(=O)(O))OC)C(=O)S1
InChI=1SC13H12N2O4S2c1320131410(12(16)2113)7869(15(17)18)4511(8)192h47H3H212H3b107
MFCD02376974
ZINC000004755236
ZINC04755236
ZINC4755236
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