Vitas-M small molecule compound

2-azido-1-[3-(naphthalen-1-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl]ethanone

Catalog ID
STK993769
SMILES [N-]=[N+]=NCC(=O)N1N=C(CC1c1ccccc1)c1cccc2c1cccc2

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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 C21H17N5O MW 355.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O/c22-25-23-14-21(27)26-20(16-8-2-1-3-9-16)13-19(24-26)18-12-6-10-15-7-4-5-11-17(15)18/h1-12,20H,13-14H2
InChIKey
LNZDJJZFWGNVQH-UHFFFAOYSA-N
Synonyms

(N)=(N+)=NCC(=O)N1N=C(CC1c1ccccc1)c1cccc2c1cccc2
2azido1(3(naphthalen1yl)5phenyl45dihydro1Hpyrazol1yl)ethanone
2azido1(5naphthalen1yl3phenyl34dihydropyrazol2yl)ethanone
C1C(N(N=C1C2=CC=CC3=CC=CC=C32)C(=O)CN=(N+)=(N))C4=CC=CC=C4
InChI=1SC21H17N5Oc2225231421(27)2620(168213916)1319(2426)1812610157451117(15)18h11220H1314H2
MFCD18185022
ZINC000102828714
ZINC000102828719

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.