Vitas-M small molecule compound
N-(2-cyano-4,5-diethoxyphenyl)-4-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
Catalog ID
STK771745
SMILES CCOc1cc(NC(=O)c2ccc(cc2)Cn2nc(cc2C)[N+](=O)[O-])c(cc1OCC)C#N
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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 C23H23N5O5 MW 449.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O5/c1-4-32-20-11-18(13-24)19(12-21(20)33-5-2)25-23(29)17-8-6-16(7-9-17)14-27-15(3)10-22(26-27)28(30)31/h6-12H,4-5,14H2,1-3H3,(H,25,29)InChIKey
MLFOKFIPXIMMQH-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C(=C1)C#N)NC(=O)C2=CC=C(C=C2)CN3C(=CC(=N3)(N+)(=O)(O))C)OCC
CCOc1cc(NC(=O)c2ccc(cc2)Cn2nc(cc2C)(N+)(=O)(O))c(cc1OCC)C#N
InChI=1SC23H23N5O5c1432201118(1324)19(1221(20)3352)2523(29)178616(7917)142715(3)1022(2627)28(30)31h612H4514H213H3(H2529)
MFCD03767533
N(2cyano45diethoxyphenyl)4((5methyl3nitro1Hpyrazol1yl)methyl)benzamide
N(2CYANO45DIETHOXYPHENYL)4((5METHYL3NITROPYRAZOL1YL)METHYL)BENZAMIDE
ZINC000001075107
ZINC01075107
ZINC1075107
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