Vitas-M small molecule compound
(4Z)-2-(4-bromophenyl)-4-{[(2-chloro-4-nitrophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL359537
SMILES Brc1ccc(cc1)N1N=C(/C(=C/Nc2ccc(cc2Cl)[N+](=O)[O-])/C1=O)C
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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 C17H12BrClN4O3 MW 435.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrClN4O3/c1-10-14(9-20-16-7-6-13(23(25)26)8-15(16)19)17(24)22(21-10)12-4-2-11(18)3-5-12/h2-9,20H,1H3/b14-9-InChIKey
WGRFRHYEGLCMMA-ZROIWOOFSA-NSynonyms
(4Z)2(4bromophenyl)4(((2chloro4nitrophenyl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4Z)2(4bromophenyl)4((2chloro4nitroanilino)methylidene)5methylpyrazol3one
Brc1ccc(cc1)N1N=C(C(=CNc2ccc(cc2Cl)(N+)(=O)(O))C1=O)C
CC1=NN(C(=O)C1=CNC2=C(C=C(C=C2)(N+)(=O)(O))Cl)C3=CC=C(C=C3)Br
InChI=1SC17H12BrClN4O3c11014(920167613(23(25)26)815(16)19)17(24)22(2110)124211(18)3512h2920H1H3b149
MFCD00606095
ZINC000101346638
ZINC101346638
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