Vitas-M small molecule compound

1,4'-bipiperidin-1'-yl[5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone

Catalog ID
STL184270
SMILES O=C(c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-])N1CCC(CC1)N1CCCCC1

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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 C20H25N5O3 MW 383.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O3/c26-20(24-12-8-16(9-13-24)23-10-2-1-3-11-23)18-14-21-22-19(18)15-4-6-17(7-5-15)25(27)28/h4-7,14,16H,1-3,8-13H2,(H,21,22)
InChIKey
YDMKTXWFQCACHY-UHFFFAOYSA-N
Synonyms

(5(4nitrophenyl)1Hpyrazol4yl)(4piperidin1ylpiperidin1yl)methanone
14bipiperidin1yl(5(4nitrophenyl)1Hpyrazol4yl)methanone
C1CCN(CC1)C2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC20H25N5O3c2620(2412816(91324)23102131123)1814212219(18)154617(7515)25(27)28h471416H13813H2(H2122)
MFCD22386412
O=C(c1cn(nH)c1c1ccc(cc1)(N+)(=O)(O))N1CCC(CC1)N1CCCCC1
ZINC000072328735
ZINC72328735

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Available files

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