Vitas-M small molecule compound

azepan-1-yl[5-(3-chlorophenyl)-1H-pyrazol-3-yl]methanone

Catalog ID
STL027232
SMILES Clc1cccc(c1)c1[nH]nc(c1)C(=O)N1CCCCCC1

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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 C16H18ClN3O MW 303.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN3O/c17-13-7-5-6-12(10-13)14-11-15(19-18-14)16(21)20-8-3-1-2-4-9-20/h5-7,10-11H,1-4,8-9H2,(H,18,19)
InChIKey
RUDGIYCBKOABSN-UHFFFAOYSA-N
Synonyms

azepan1yl(3(3chlorophenyl)1Hpyrazol5yl)methanone
azepan1yl(5(3chlorophenyl)1Hpyrazol3yl)methanone
C1CCCN(CC1)C(=O)C2=CC(=NN2)C3=CC(=CC=C3)Cl
Clc1cccc(c1)c1(nH)nc(c1)C(=O)N1CCCCCC1
InChI=1SC16H18ClN3Oc171375612(1013)141115(191814)16(21)2083124920h571011H1489H2(H1819)
MFCD18187890
ZINC000057413329
ZINC57413329

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Available files

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