Vitas-M small molecule compound
4-chloro-N-[3-(1H-imidazol-1-yl)propyl]-3-nitrobenzamide
Catalog ID
STK086170
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)NCCCn1cncc1
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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 C13H13ClN4O3 MW 308.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN4O3/c14-11-3-2-10(8-12(11)18(20)21)13(19)16-4-1-6-17-7-5-15-9-17/h2-3,5,7-9H,1,4,6H2,(H,16,19)InChIKey
MDPRKBDITYOVMD-UHFFFAOYSA-NSynonyms
349096-31-7(4CHLORO3NITROPHENYL)N(3IMIDAZOLYLPROPYL)CARBOXAMIDE
349096317
4CHLORON(3(1HIMIDAZOL1YL)PROPYL)3NITROBENZAMIDE
4CHLORON(3IMIDAZOL1YLPROPYL)3NITROBENZAMIDE
C1=CC(=C(C=C1C(=O)NCCCN2C=CN=C2)(N+)(=O)(O))Cl
InChI=1SC13H13ClN4O3c14113210(812(11)18(20)21)13(19)16416177515917h23579H146H2(H1619)
MFCD02054239
O=C(c1ccc(c(c1)(N+)(=O)(O))Cl)NCCCn1cncc1
STK086170
ZINC000004663852
ZINC4663852
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