Vitas-M small molecule compound
2-(methylsulfanyl)-N-[(E)-{3-nitro-4-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]phenyl}methylidene]-1,3-benzothiazol-6-amine
Catalog ID
STK673287
SMILES CSc1nc2c(s1)cc(cc2)/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cc(cc2)[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 C22H13N5O4S4 MW 539.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13N5O4S4/c1-32-21-24-15-5-3-13(9-19(15)34-21)23-11-12-2-7-18(17(8-12)27(30)31)33-22-25-16-6-4-14(26(28)29)10-20(16)35-22/h2-11H,1H3/b23-11+InChIKey
PLPFOTCRMXNMCB-FOKLQQMPSA-NSynonyms
2(methylsulfanyl)N((E)(3nitro4((6nitro13benzothiazol2yl)sulfanyl)phenyl)methylidene)13benzothiazol6amine
CSc1nc2c(s1)cc(cc2)N=Cc1ccc(c(c1)(N+)(=O)(O))Sc1nc2c(s1)cc(cc2)(N+)(=O)(O)
MFCD00760566
ZINC000100057131
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