Vitas-M small molecule compound
1-(2,3-dimethylphenyl)-3-{(Z)-[3-methyl-1-(3-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}urea
Catalog ID
STK287740
SMILES Cc1cccc(c1)N1N=C(/C(=C/NC(=O)Nc2cccc(c2C)C)/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 C21H22N4O2 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2/c1-13-7-5-9-17(11-13)25-20(26)18(16(4)24-25)12-22-21(27)23-19-10-6-8-14(2)15(19)3/h5-12H,1-4H3,(H2,22,23,27)/b18-12-InChIKey
YYGVMVONHDBROI-PDGQHHTCSA-NSynonyms
1(23dimethylphenyl)3((Z)(3methyl1(3methylphenyl)5oxo15dihydro4Hpyrazol4ylidene)methyl)urea
1(23dimethylphenyl)3((Z)(3methyl1(3methylphenyl)5oxopyrazol4ylidene)methyl)urea
CC1=CC(=CC=C1)N2C(=O)C(=CNC(=O)NC3=CC=CC(=C3C)C)C(=N2)C
Cc1cccc(c1)N1N=C(C(=CNC(=O)Nc2cccc(c2C)C)C1=O)C
InChI=1SC21H22N4O2c11375917(1113)2520(26)18(16(4)2425)122221(27)2319106814(2)15(19)3h512H14H3(H2222327)b1812
MFCD09271045
ZINC000102516031
ZINC102516031
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