Vitas-M small molecule compound

1-(1,3-benzodioxol-5-ylmethyl)-4-(4-nitro-1H-pyrazol-5-yl)piperazine

Catalog ID
STK303069
SMILES [O-][N+](=O)c1cn[nH]c1N1CCN(CC1)Cc1ccc2c(c1)OCO2

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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 C15H17N5O4 MW 331.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N5O4/c21-20(22)12-8-16-17-15(12)19-5-3-18(4-6-19)9-11-1-2-13-14(7-11)24-10-23-13/h1-2,7-8H,3-6,9-10H2,(H,16,17)
InChIKey
SDZBJRFCTOAZOS-UHFFFAOYSA-N
Synonyms
1039001-26-7
(O)(N+)(=O)c1cn(nH)c1N1CCN(CC1)Cc1ccc2c(c1)OCO2
1(13benzodioxol5ylmethyl)4(4nitro1Hpyrazol5yl)piperazine
1039001267
5((4(4NITROPYRAZOL5YL)PIPERAZINYL)METHYL)2HBENZO(D)13DIOXOLENE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=C(C=NN4)(N+)(=O)(O)
InChI=1SC15H17N5O4c2120(22)128161715(12)195318(4619)911121314(711)24102313h1278H36910H2(H1617)
MFCD04044570
ZINC000006829245
ZINC6829245

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Available files

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