Vitas-M small molecule compound

N-(2-{(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]benzenesulfonamide (non-preferred name)

Catalog ID
STL087016
SMILES O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)C(F)(F)F)Cl)N/N=C/c1cc2OCOc2cc1Br

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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 C23H16BrClF3N3O5S MW 618.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrClF3N3O5S/c24-18-10-21-20(35-13-36-21)8-14(18)11-29-30-22(32)12-31(37(33,34)16-4-2-1-3-5-16)15-6-7-19(25)17(9-15)23(26,27)28/h1-11H,12-13H2,(H,30,32)/b29-11+
InChIKey
OCSLPEYDLIZGON-VPUKRXIYSA-N
Synonyms

2(N(benzenesulfonyl)4chloro3(trifluoromethyl)anilino)N((E)(6bromo13benzodioxol5yl)methylideneamino)acetamide
C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)CN(C3=CC(=C(C=C3)Cl)C(F)(F)F)S(=O)(=O)C4=CC=CC=C4)Br
InChI=1SC23H16BrClF3N3O5Sc2418102120(35133621)814(18)11293022(32)1231(37(3334)164213516)156719(25)17(915)23(2627)28h111H1213H2(H3032)b2911+
MFCD02071684
N(2((2E)2((6bromo13benzodioxol5yl)methylidene)hydrazinyl)2oxoethyl)N(4chloro3(trifluoromethyl)phenyl)benzenesulfonamide(nonpreferredname)
N(2(2((6BROMO13BENZODIOXOL5YL)METHYLENE)HYDRAZINO)2OXOETHYL)N(4CHLORO3(TRIFLUOROMETHYL)PHENYL)BENZENESULFONAMIDE
O=C(CN(S(=O)(=O)c1ccccc1)c1ccc(c(c1)C(F)(F)F)Cl)NN=Cc1cc2OCOc2cc1Br
ZINC000008439791
ZINC150370482

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Available files

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