Vitas-M small molecule compound
[(4-bromophenyl)(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methyl]propanedinitrile
Catalog ID
STK007868
SMILES N#CC(C(C1C(=NN(C1=O)c1ccccc1)C)c1ccc(cc1)Br)C#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 C20H15BrN4O MW 407.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN4O/c1-13-18(20(26)25(24-13)17-5-3-2-4-6-17)19(15(11-22)12-23)14-7-9-16(21)10-8-14/h2-10,15,18-19H,1H3InChIKey
XREZHCRBWZQGBU-UHFFFAOYSA-NSynonyms
82805-65-0((4BROMOPHENYL)(3METHYL5OXO1PHENYL45DIHYDRO1HPYRAZOL4YL)METHYL)PROPANEDINITRILE
2((4bromophenyl)(3methyl5oxo1phenyl45dihydro1Hpyrazol4yl)methyl)malononitrile
2((4BROMOPHENYL)(3METHYL5OXO1PHENYL4HPYRAZOL4YL)METHYL)PROPANEDINITRILE
82805650
CC1=NN(C(=O)C1C(C2=CC=C(C=C2)Br)C(C#N)C#N)C3=CC=CC=C3
InChI=1SC20H15BrN4Oc11318(20(26)25(2413)175324617)19(15(1122)1223)147916(21)10814h210151819H1H3
MFCD01105787
N#CC(C(C1C(=NN(C1=O)c1ccccc1)C)c1ccc(cc1)Br)C#N
STK007868
ZINC000000837273
ZINC000100557898
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