Vitas-M small molecule compound
(4Z)-4-(1-{[1-(2,4-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]amino}ethylidene)-5-methyl-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK149768
SMILES Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)N/C(=C\1/C(=NN(C1=O)c1ccc(cc1)[N+](=O)[O-])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 C24H22Cl2N6O3 MW 513.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Cl2N6O3/c1-13(22-14(2)29-31(24(22)33)19-7-9-20(10-8-19)32(34)35)27-23-15(3)28-30(16(23)4)12-17-5-6-18(25)11-21(17)26/h5-11,27H,12H2,1-4H3/b22-13-InChIKey
HQAPCUQIKVATKE-XKZIYDEJSA-NSynonyms
(4Z)4(1((1((24dichlorophenyl)methyl)35dimethylpyrazol4yl)amino)ethylidene)5methyl2(4nitrophenyl)pyrazol3one
(4Z)4(1((1(24DICHLOROBENZYL)35DIMETHYL1HPYRAZOL4YL)AMINO)ETHYLIDENE)5METHYL2(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
4(((1((24DICHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)AMINO)ETHYLIDENE)3METHYL1(4NITROPHENYL)12DIAZOLIN5ONE
CC1=C(C(=NN1CC2=C(C=C(C=C2)Cl)Cl)C)NC(=C3C(=NN(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))C)C
Clc1ccc(c(c1)Cl)Cn1nc(c(c1C)NC(=C1C(=NN(C1=O)c1ccc(cc1)(N+)(=O)(O))C)C)C
InChI=1SC24H22Cl2N6O3c113(2214(2)2931(24(22)33)197920(10819)32(34)35)272315(3)2830(16(23)4)12175618(25)1121(17)26h51127H12H214H3b2213
MFCD04020550
ZINC000009720402
ZINC9720402
Check stock
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Check stock on Vitas-MAvailable files
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