Vitas-M small molecule compound
3-{[2-(1H-benzimidazol-2-yl)ethyl]amino}-5,5-dimethyl-2-propanoylcyclohex-2-en-1-one
Catalog ID
STK684555
SMILES CCC(=O)C1=C(NCCc2nc3c([nH]2)cccc3)CC(CC1=O)(C)C
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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 C20H25N3O2 MW 339.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O2/c1-4-16(24)19-15(11-20(2,3)12-17(19)25)21-10-9-18-22-13-7-5-6-8-14(13)23-18/h5-8,21H,4,9-12H2,1-3H3,(H,22,23)InChIKey
XMRGACFURZVPAD-UHFFFAOYSA-NSynonyms
3((2(1Hbenzimidazol2yl)ethyl)amino)55dimethyl2propanoylcyclohex2en1one
3((2(1HBENZIMIDAZOL2YL)ETHYL)AMINO)55DIMETHYL2PROPIONYLCYCLOHEX2EN1ONE
3(2(1HBENZIMIDAZOL2YL)ETHYLAMINO)55DIMETHYL2PROPANOYLCYCLOHEX2EN1ONE
CCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=NC3=CC=CC=C3N2
CCC(=O)C1=C(NCCc2nc3c((nH)2)cccc3)CC(CC1=O)(C)C
InChI=1SC20H25N3O2c1416(24)1915(1120(23)1217(19)25)21109182213756814(13)2318h5821H4912H213H3(H2223)
MFCD05854955
ZINC000001425779
ZINC1425779
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