Vitas-M small molecule compound
5-({(Z)-[1-(4-bromo-2-methylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL359746
SMILES Brc1ccc(c(c1)C)N1N=C(/C(=C/Nc2ccc3c(c2)[nH]c(=O)[nH]3)/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 C19H16BrN5O2 MW 426.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN5O2/c1-10-7-12(20)3-6-17(10)25-18(26)14(11(2)24-25)9-21-13-4-5-15-16(8-13)23-19(27)22-15/h3-9,21H,1-2H3,(H2,22,23,27)/b14-9-InChIKey
RUSSKOOTPUGQFB-ZROIWOOFSA-NSynonyms
5(((Z)(1(4bromo2methylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)13dihydro2Hbenzimidazol2one
5(((Z)(1(4bromo2methylphenyl)3methyl5oxopyrazol4ylidene)methyl)amino)13dihydrobenzimidazol2one
Brc1ccc(c(c1)C)N1N=C(C(=CNc2ccc3c(c2)(nH)c(=O)(nH)3)C1=O)C
CC1=C(C=CC(=C1)Br)N2C(=O)C(=CNC3=CC4=C(C=C3)NC(=O)N4)C(=N2)C
InChI=1SC19H16BrN5O2c110712(20)3617(10)2518(26)14(11(2)2425)92113451516(813)2319(27)2215h3921H12H3(H2222327)b149
MFCD28033782
ZINC000020036808
ZINC20036808
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