Vitas-M small molecule compound
2-benzyl-4,6-dinitro-1,2-benzothiazol-3(2H)-one
Catalog ID
STK756759
SMILES [O-][N+](=O)c1cc(cc2c1c(=O)n(s2)Cc1ccccc1)[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 C14H9N3O5S MW 331.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N3O5S/c18-14-13-11(17(21)22)6-10(16(19)20)7-12(13)23-15(14)8-9-4-2-1-3-5-9/h1-7H,8H2InChIKey
WACNBAVOQAQCIG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(cc2c1c(=O)n(s2)Cc1ccccc1)(N+)(=O)(O)
2BENZYL46DINITRO12BENZISOTHIAZOL3(2H)ONE
2BENZYL46DINITRO12BENZISOTHIAZOLE3(2H)ONE
2benzyl46dinitro12benzothiazol3(2H)one
2BENZYL46DINITRO12BENZOTHIAZOL3ONE
46DINITRO2(PHENYLMETHYL)12BENZOTHIAZOL3ONE
46DINITRO2BENZYL2HYDROBENZO(D)ISOTHIAZOL3ONE
C1=CC=C(C=C1)CN2C(=O)C3=C(C=C(C=C3S2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC14H9N3O5Sc18141311(17(21)22)610(16(19)20)712(13)2315(14)89421359h17H8H2
MFCD01305673
ZINC000003664447
ZINC03664447
ZINC3664447
Check stock
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