Vitas-M small molecule compound
1-[3-(4-bromophenyl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Catalog ID
STK857658
SMILES CCC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccc(cc1)Br
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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 C20H17BrN4O MW 409.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrN4O/c1-2-20(26)25-19(12-17(24-25)13-3-6-15(21)7-4-13)14-5-8-16-18(11-14)23-10-9-22-16/h3-11,19H,2,12H2,1H3InChIKey
BJBJCRWBQIIZPI-UHFFFAOYSA-NSynonyms
1007782-80-01(3(4bromophenyl)5(quinoxalin6yl)45dihydro1Hpyrazol1yl)propan1one
1(5(4bromophenyl)3quinoxalin6yl34dihydropyrazol2yl)propan1one
1007782800
CCC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Br)C3=CC4=NC=CN=C4C=C3
InChI=1SC20H17BrN4Oc1220(26)2519(1217(2425)133615(21)7413)14581618(1114)231092216h31119H212H21H3
MFCD09983472
ZINC000011692676
ZINC000011692677
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