Vitas-M small molecule compound
azepan-1-yl[5-(4-chlorophenyl)-1H-pyrazol-3-yl]methanone
Catalog ID
STK879668
SMILES Clc1ccc(cc1)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/c17-13-7-5-12(6-8-13)14-11-15(19-18-14)16(21)20-9-3-1-2-4-10-20/h5-8,11H,1-4,9-10H2,(H,18,19)InChIKey
KNDGHVBRWYCCBY-UHFFFAOYSA-NSynonyms
azepan1yl(3(4chlorophenyl)1Hpyrazol5yl)methanone
azepan1yl(5(4chlorophenyl)1Hpyrazol3yl)methanone
C1CCCN(CC1)C(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl
Clc1ccc(cc1)c1(nH)nc(c1)C(=O)N1CCCCCC1
InChI=1SC16H18ClN3Oc17137512(6813)141115(191814)16(21)20931241020h5811H14910H2(H1819)
MFCD18170986
ZINC000006942274
ZINC06942274
ZINC6942274
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