Vitas-M small molecule compound

4-[(2,4-dichlorophenoxy)methyl]-N-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]benzamide

Catalog ID
STK308441
SMILES Clc1ccc(c(c1)Cl)OCc1ccc(cc1)C(=O)NCCn1nc(c(c1C)[N+](=O)[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 C21H20Cl2N4O4 MW 463.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl2N4O4/c1-13-20(27(29)30)14(2)26(25-13)10-9-24-21(28)16-5-3-15(4-6-16)12-31-19-8-7-17(22)11-18(19)23/h3-8,11H,9-10,12H2,1-2H3,(H,24,28)
InChIKey
ZHXMOSVMIRBJEC-UHFFFAOYSA-N
Synonyms
1005700-19-5
1005700195
4((24dichlorophenoxy)methyl)N(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)benzamide
4((24DICHLOROPHENOXY)METHYL)N(2(35DIMETHYL4NITROPYRAZOL1YL)ETHYL)BENZAMIDE
CC1=C(C(=NN1CCNC(=O)C2=CC=C(C=C2)COC3=C(C=C(C=C3)Cl)Cl)C)(N+)(=O)(O)
Clc1ccc(c(c1)Cl)OCc1ccc(cc1)C(=O)NCCn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC21H20Cl2N4O4c11320(27(29)30)14(2)26(2513)1092421(28)165315(4616)1231198717(22)1118(19)23h3811H91012H212H3(H2428)
MFCD04132235
ZINC000002796588
ZINC02796588
ZINC2796588

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Available files

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