Vitas-M small molecule compound
2-(4-nitro-1H-pyrazol-1-yl)-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]acetamide
Catalog ID
STK302158
SMILES Cc1cc(Oc2cc(NC(=O)Cn3ncc(c3)[N+](=O)[O-])cc(c2)[N+](=O)[O-])c(c(c1)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 C20H19N5O6 MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O6/c1-12-4-13(2)14(3)19(5-12)31-18-7-15(6-16(8-18)24(27)28)22-20(26)11-23-10-17(9-21-23)25(29)30/h4-10H,11H2,1-3H3,(H,22,26)InChIKey
NMMLOWKGDXLGOX-UHFFFAOYSA-NSynonyms
512816-12-52(4nitro1Hpyrazol1yl)N(3nitro5(235trimethylphenoxy)phenyl)acetamide
2(4NITROPYRAZOL1YL)N(3NITRO5(235TRIMETHYLPHENOXY)PHENYL)ACETAMIDE
512816125
CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)CN3C=C(C=N3)(N+)(=O)(O))C)C
Cc1cc(Oc2cc(NC(=O)Cn3ncc(c3)(N+)(=O)(O))cc(c2)(N+)(=O)(O))c(c(c1)C)C
InChI=1SC20H19N5O6c112413(2)14(3)19(512)3118715(616(818)24(27)28)2220(26)11231017(92123)25(29)30h410H11H213H3(H2226)
MFCD03467371
ZINC000002113037
ZINC02113037
ZINC2113037
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