Vitas-M small molecule compound
N-{(5Z)-2-butyl-1-[(4-ethoxy-3-nitrophenyl)carbonyl]-1,2-dihydro-5H-tetrazol-5-ylidene}-4-ethoxy-3-nitrobenzamide
Catalog ID
STL289897
SMILES CCCCn1nn/c(=N\C(=O)c2ccc(c(c2)[N+](=O)[O-])OCC)/n1C(=O)c1ccc(c(c1)[N+](=O)[O-])OCC
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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 C23H25N7O8 MW 527.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N7O8/c1-4-7-12-27-26-25-23(24-21(31)15-8-10-19(37-5-2)17(13-15)29(33)34)28(27)22(32)16-9-11-20(38-6-3)18(14-16)30(35)36/h8-11,13-14H,4-7,12H2,1-3H3/b24-23+InChIKey
DYWJXFPBIMYIGM-WCWDXBQESA-NSynonyms
CCCCn1nnc(=NC(=O)c2ccc(c(c2)(N+)(=O)(O))OCC)n1C(=O)c1ccc(c(c1)(N+)(=O)(O))OCC
MFCD24847360
N((5Z)2butyl1((4ethoxy3nitrophenyl)carbonyl)12dihydro5Htetrazol5ylidene)4ethoxy3nitrobenzamide
ZINC000097971304
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