Vitas-M small molecule compound

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

Catalog ID
STK171086
SMILES CCn1c(=O)n(c2c1cc(N1CCNCC1)c(c2)[N+](=O)[O-])CC

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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 C15H21N5O3 MW 319.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21N5O3/c1-3-18-12-9-11(17-7-5-16-6-8-17)14(20(22)23)10-13(12)19(4-2)15(18)21/h9-10,16H,3-8H2,1-2H3
InChIKey
WRQKKSXNXWTCCZ-UHFFFAOYSA-N
Synonyms
696597-81-6
13DIETHYL5NITRO6(PIPERAZIN1YL)13DIHYDRO2HBENZIMIDAZOL2ONE
13diethyl5nitro6(piperazin1yl)1Hbenzo(d)imidazol2(3H)one
13DIETHYL5NITRO6PIPERAZIN1YL13DIHYDROBENZOIMIDAZOL2ONE
13DIETHYL5NITRO6PIPERAZIN1YLBENZIMIDAZOL2ONE
13DIETHYL6NITRO5PIPERAZINYL3HYDROBENZIMIDAZOL2ONE
696597816
CCn1c(=O)n(c2c1cc(N1CCNCC1)c(c2)(N+)(=O)(O))CC
CCN1C2=CC(=C(C=C2N(C1=O)CC)(N+)(=O)(O))N3CCNCC3
InChI=1SC15H21N5O3c131812911(1775166817)14(20(22)23)1013(12)19(42)15(18)21h91016H38H212H3
MFCD04175421
ZINC000004458466
ZINC4458466

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Available files

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