Vitas-M small molecule compound

2-(5-methyl-3-nitro-1H-pyrazol-1-yl)-N-{4-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl}acetamide

Catalog ID
STK784263
SMILES COc1cc(cc(c1OC)OC)c1onc(n1)c1ccc(cc1)NC(=O)Cn1nc(cc1C)[N+](=O)[O-]

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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 C23H22N6O7 MW 494.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N6O7/c1-13-9-19(29(31)32)26-28(13)12-20(30)24-16-7-5-14(6-8-16)22-25-23(36-27-22)15-10-17(33-2)21(35-4)18(11-15)34-3/h5-11H,12H2,1-4H3,(H,24,30)
InChIKey
IVNXJRPKRXEGQA-UHFFFAOYSA-N
Synonyms

2(5methyl3nitro1Hpyrazol1yl)N(4(5(345trimethoxyphenyl)124oxadiazol3yl)phenyl)acetamide
2(5METHYL3NITROPYRAZOL1YL)N(4(5(345TRIMETHOXYPHENYL)124OXADIAZOL3YL)PHENYL)ACETAMIDE
CC1=CC(=NN1CC(=O)NC2=CC=C(C=C2)C3=NOC(=N3)C4=CC(=C(C(=C4)OC)OC)OC)(N+)(=O)(O)
COc1cc(cc(c1OC)OC)c1onc(n1)c1ccc(cc1)NC(=O)Cn1nc(cc1C)(N+)(=O)(O)
InChI=1SC23H22N6O7c113919(29(31)32)2628(13)1220(30)24167514(6816)222523(362722)151017(332)21(354)18(1115)343h511H12H214H3(H2430)
MFCD07021778
ZINC000012446605
ZINC12446605

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Available files

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