Vitas-M small molecule compound
(4E)-2-benzyl-4-(3,4-dichlorobenzylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK330462
SMILES CC1=NN(C(=O)/C/1=C/c1ccc(c(c1)Cl)Cl)Cc1ccccc1
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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 C18H14Cl2N2O MW 345.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2N2O/c1-12-15(9-14-7-8-16(19)17(20)10-14)18(23)22(21-12)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3/b15-9+InChIKey
MDUXOWOLCWKARO-OQLLNIDSSA-NSynonyms
(4E)2benzyl4((34dichlorophenyl)methylidene)5methylpyrazol3one
(4E)2benzyl4(34dichlorobenzylidene)5methyl24dihydro3Hpyrazol3one
CC1=NN(C(=O)C1=Cc1ccc(c(c1)Cl)Cl)Cc1ccccc1
CC1=NN(C(=O)C1=CC2=CC(=C(C=C2)Cl)Cl)CC3=CC=CC=C3
InChI=1SC18H14Cl2N2Oc11215(9147816(19)17(20)1014)18(23)22(2112)11135324613h210H11H21H3b159+
MFCD09962223
ZINC000102036867
ZINC102036867
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