Vitas-M small molecule compound

1-(morpholin-4-yl)-3-(6-nitro-1H-benzimidazol-2-yl)propan-1-one

Catalog ID
STK602644
SMILES O=C(N1CCOCC1)CCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]

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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 C14H16N4O4 MW 304.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O4/c19-14(17-5-7-22-8-6-17)4-3-13-15-11-2-1-10(18(20)21)9-12(11)16-13/h1-2,9H,3-8H2,(H,15,16)
InChIKey
KXOBMEZEKNHUIM-UHFFFAOYSA-N
Synonyms
903862-67-9
1(morpholin4yl)3(6nitro1Hbenzimidazol2yl)propan1one
1morpholin4yl3(6nitro1Hbenzimidazol2yl)propan1one
1morpholino3(5nitro1Hbenzo(d)imidazol2yl)propan1one
903862679
C1COCCN1C(=O)CCC2=NC3=C(N2)C=C(C=C3)(N+)(=O)(O)
InChI=1SC14H16N4O4c1914(1757228617)431315112110(18(20)21)912(11)1613h129H38H2(H1516)
MFCD08730793
O=C(N1CCOCC1)CCc1nc2c((nH)1)cc(cc2)(N+)(=O)(O)
O=C(N1CCOCC1)CCc1nc2c((nH)1)ccc(c2)(N+)(=O)(O)
ZINC000008996840
ZINC08996840
ZINC8996840

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Available files

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