Vitas-M small molecule compound
1-{(Z)-[1-(4-bromo-2,3-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-3-(2-ethylphenyl)urea
Catalog ID
STK287732
SMILES CCc1ccccc1NC(=O)N/C=C\1/C(=NN(C1=O)c1ccc(c(c1C)C)Br)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 C22H23BrN4O2 MW 455.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN4O2/c1-5-16-8-6-7-9-19(16)25-22(29)24-12-17-15(4)26-27(21(17)28)20-11-10-18(23)13(2)14(20)3/h6-12H,5H2,1-4H3,(H2,24,25,29)/b17-12-InChIKey
CVNOOASMVUAYDR-ATVHPVEESA-NSynonyms
1((Z)(1(4bromo23dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)3(2ethylphenyl)urea
1((Z)(1(4bromo23dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)3(2ethylphenyl)urea
CCC1=CC=CC=C1NC(=O)NC=C2C(=NN(C2=O)C3=C(C(=C(C=C3)Br)C)C)C
CCc1ccccc1NC(=O)NC=C1C(=NN(C1=O)c1ccc(c(c1C)C)Br)C
InChI=1SC22H23BrN4O2c1516867919(16)2522(29)24121715(4)2627(21(17)28)20111018(23)13(2)14(20)3h612H5H214H3(H2242529)b1712
MFCD09271044
ZINC000102516039
ZINC102516039
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