Vitas-M small molecule compound
2-acetyl-3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-5-phenylcyclohex-2-en-1-one
Catalog ID
STK684551
SMILES CC(=O)C1=C(NCCc2nc3c([nH]2)cccc3)CC(CC1=O)c1ccccc1
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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 C23H23N3O2 MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2/c1-15(27)23-20(13-17(14-21(23)28)16-7-3-2-4-8-16)24-12-11-22-25-18-9-5-6-10-19(18)26-22/h2-10,17,24H,11-14H2,1H3,(H,25,26)InChIKey
XVMZPMXVDFFJTJ-UHFFFAOYSA-NSynonyms
2acetyl3((2(1Hbenzimidazol2yl)ethyl)amino)5phenylcyclohex2en1one
2ACETYL3(2(1HBENZIMIDAZOL2YL)ETHYLAMINO)5PHENYLCYCLOHEX2EN1ONE
CC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=NC4=CC=CC=C4N3
CC(=O)C1=C(NCCc2nc3c((nH)2)cccc3)CC(CC1=O)c1ccccc1
InChI=1SC23H23N3O2c115(27)2320(1317(1421(23)28)167324816)2412112225189561019(18)2622h2101724H1114H21H3(H2526)
MFCD05854951
ZINC000100168925
ZINC000100168929
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