Vitas-M small molecule compound
4-[(4Z)-4-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzenesulfonamide
Catalog ID
STL432593
SMILES CC1=NN(C(=O)/C/1=C\c1ccc(o1)c1ccc(cc1Br)[N+](=O)[O-])c1ccc(cc1)S(=O)(=O)N
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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 C21H15BrN4O6S MW 531.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN4O6S/c1-12-18(21(27)25(24-12)13-2-6-16(7-3-13)33(23,30)31)11-15-5-9-20(32-15)17-8-4-14(26(28)29)10-19(17)22/h2-11H,1H3,(H2,23,30,31)/b18-11-InChIKey
OPTJAKIZORNOMU-WQRHYEAKSA-NSynonyms
4((4Z)4((5(2bromo4nitrophenyl)furan2yl)methylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzenesulfonamide
4((4Z)4((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZENESULFONAMIDE
CC1=NN(C(=O)C1=Cc1ccc(o1)c1ccc(cc1Br)(N+)(=O)(O))c1ccc(cc1)S(=O)(=O)N
CC1=NN(C(=O)C1=CC2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Br)C4=CC=C(C=C4)S(=O)(=O)N
InChI=1SC21H15BrN4O6Sc11218(21(27)25(2412)132616(7313)33(2330)31)11155920(3215)178414(26(28)29)1019(17)22h211H1H3(H2233031)b1811
MFCD02907826
ZINC000033355293
ZINC33355293
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