Vitas-M small molecule compound

N-[3-({[(2,4-dinitrophenyl)carbonyl]amino}methyl)-3,5,5-trimethylcyclohexyl]-2,4-dinitrobenzamide

Catalog ID
STL170198
SMILES O=C(c1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])NCC1(C)CC(NC(=O)c2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])CC(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 C24H26N6O10 MW 558.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O10/c1-23(2)10-14(26-22(32)18-7-5-16(28(35)36)9-20(18)30(39)40)11-24(3,12-23)13-25-21(31)17-6-4-15(27(33)34)8-19(17)29(37)38/h4-9,14H,10-13H2,1-3H3,(H,25,31)(H,26,32)
InChIKey
YMEPFKDAUUAOLX-UHFFFAOYSA-N
Synonyms

CC1(CC(CC(C1)(C)CNC(=O)C2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))NC(=O)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O))C
InChI=1SC24H26N6O10c123(2)1014(2622(32)187516(28(35)36)920(18)30(39)40)1124(31223)132521(31)176415(27(33)34)819(17)29(37)38h4914H1013H213H3(H2531)(H2632)
MFCD03400955
N((5((24DINITROBENZOYL)AMINO)133TRIMETHYLCYCLOHEXYL)METHYL)24DINITROBENZAMIDE
N(3((((24dinitrophenyl)carbonyl)amino)methyl)355trimethylcyclohexyl)24dinitrobenzamide
O=C(c1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))NCC1(C)CC(NC(=O)c2ccc(cc2(N+)(=O)(O))(N+)(=O)(O))CC(C1)(C)C
ZINC000103245962
ZINC000103245972

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Available files

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