Vitas-M small molecule compound
1-{(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-3-(3,4-dimethylphenyl)urea
Catalog ID
STK287721
SMILES O=C(Nc1ccc(c(c1)C)C)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)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 C20H19BrN4O2 MW 427.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19BrN4O2/c1-12-4-7-16(10-13(12)2)23-20(27)22-11-18-14(3)24-25(19(18)26)17-8-5-15(21)6-9-17/h4-11H,1-3H3,(H2,22,23,27)/b18-11-InChIKey
UZKJYAPCAWGOGK-WQRHYEAKSA-NSynonyms
1((Z)(1(4bromophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)3(34dimethylphenyl)urea
1((Z)(1(4bromophenyl)3methyl5oxopyrazol4ylidene)methyl)3(34dimethylphenyl)urea
CC1=C(C=C(C=C1)NC(=O)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)Br)C)C
InChI=1SC20H19BrN4O2c1124716(1013(12)2)2320(27)22111814(3)2425(19(18)26)178515(21)6917h411H13H3(H2222327)b1811
MFCD02299701
O=C(Nc1ccc(c(c1)C)C)NC=C1C(=NN(C1=O)c1ccc(cc1)Br)C
ZINC000100148452
ZINC100148452
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