Vitas-M small molecule compound
1-{(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-3-phenylurea
Catalog ID
STK281973
SMILES O=C(Nc1ccccc1)N/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C)C)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 C20H20N4O2 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2/c1-13-9-10-17(11-14(13)2)24-19(25)18(15(3)23-24)12-21-20(26)22-16-7-5-4-6-8-16/h4-12H,1-3H3,(H2,21,22,26)/b18-12-InChIKey
VMJCQUDQHNDTJG-PDGQHHTCSA-NSynonyms
1((Z)(1(34dimethylphenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)3phenylurea
1((Z)(1(34dimethylphenyl)3methyl5oxopyrazol4ylidene)methyl)3phenylurea
CC1=C(C=C(C=C1)N2C(=O)C(=CNC(=O)NC3=CC=CC=C3)C(=N2)C)C
InChI=1SC20H20N4O2c11391017(1114(13)2)2419(25)18(15(3)2324)122120(26)22167546816h412H13H3(H2212226)b1812
MFCD09270131
O=C(Nc1ccccc1)NC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C
ZINC000102522397
ZINC09195687
ZINC102522397
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