Vitas-M small molecule compound

2-[(2-nitrophenyl)amino]-2-oxoethyl 6-(5-methyl-2-oxo-2,3-dihydro-1H-imidazol-4-yl)-6-oxohexanoate

Catalog ID
STK239257
SMILES O=C(Nc1ccccc1[N+](=O)[O-])COC(=O)CCCCC(=O)c1[nH]c(=O)[nH]c1C

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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 C18H20N4O7 MW 404.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O7/c1-11-17(21-18(26)19-11)14(23)8-4-5-9-16(25)29-10-15(24)20-12-6-2-3-7-13(12)22(27)28/h2-3,6-7H,4-5,8-10H2,1H3,(H,20,24)(H2,19,21,26)
InChIKey
AVCWXMLWMICDGF-UHFFFAOYSA-N
Synonyms
311332-00-0
(2(2NITROANILINO)2OXOETHYL)6(5METHYL2OXO13DIHYDROIMIDAZOL4YL)6OXOHEXANOATE
2((2nitrophenyl)amino)2oxoethyl6(5methyl2oxo23dihydro1Himidazol4yl)6oxohexanoate
311332000
CC1=C(NC(=O)N1)C(=O)CCCCC(=O)OCC(=O)NC2=CC=CC=C2(N+)(=O)(O)
InChI=1SC18H20N4O7c11117(2118(26)1911)14(23)845916(25)291015(24)2012623713(12)22(27)28h2367H45810H21H3(H2024)(H2192126)
MFCD00824922
O=C(Nc1ccccc1(N+)(=O)(O))COC(=O)CCCCC(=O)c1(nH)c(=O)(nH)c1C
ZINC000009056817
ZINC09056817
ZINC9056817

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Available files

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