Vitas-M small molecule compound

1,3-dimethyl-5-nitro-6-(piperazin-1-yl)-1,3-dihydro-2H-benzimidazol-2-one

Catalog ID
STK172443
SMILES [O-][N+](=O)c1cc2c(cc1N1CCNCC1)n(c(=O)n2C)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 C13H17N5O3 MW 291.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N5O3/c1-15-9-7-11(17-5-3-14-4-6-17)12(18(20)21)8-10(9)16(2)13(15)19/h7-8,14H,3-6H2,1-2H3
InChIKey
JYXDFYWIKLODDC-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cc2c(cc1N1CCNCC1)n(c(=O)n2C)C
13DIMETHYL5NITRO6(PIPERAZIN1YL)13DIHYDRO2HBENZIMIDAZOL2ONE
13DIMETHYL5NITRO6PIPERAZIN1YL13DIHYDROBENZOIMIDAZOL2ONE
13DIMETHYL5NITRO6PIPERAZIN1YLBENZIMIDAZOL2ONE
CN1C2=CC(=C(C=C2N(C1=O)C)(N+)(=O)(O))N3CCNCC3
InChI=1SC13H17N5O3c1159711(1753144617)12(18(20)21)810(9)16(2)13(15)19h7814H36H212H3
MFCD04220098
ZINC000004458510
ZINC4458510

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Available files

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