Vitas-M small molecule compound

N-{[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-4-nitro-N-(propan-2-yl)benzamide

Catalog ID
STK266835
SMILES COc1ccc(cc1)c1noc(n1)CN(C(=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 C20H20N4O5 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O5/c1-13(2)23(20(25)15-4-8-16(9-5-15)24(26)27)12-18-21-19(22-29-18)14-6-10-17(28-3)11-7-14/h4-11,13H,12H2,1-3H3
InChIKey
CPVCFBPLGDCYMG-UHFFFAOYSA-N
Synonyms

CC(C)N(CC1=NC(=NO1)C2=CC=C(C=C2)OC)C(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(cc1)c1noc(n1)CN(C(=O)c1ccc(cc1)(N+)(=O)(O))C(C)C
InChI=1SC20H20N4O5c113(2)23(20(25)154816(9515)24(26)27)12182119(222918)1461017(283)11714h41113H12H213H3
MFCD05853099
N((3(4methoxyphenyl)124oxadiazol5yl)methyl)4nitroN(propan2yl)benzamide
N((3(4methoxyphenyl)124oxadiazol5yl)methyl)4nitroNpropan2ylbenzamide
ZINC000009582074
ZINC09582074
ZINC9582074

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.