Vitas-M small molecule compound
2-(1,3-dihydro-2H-benzimidazol-2-ylidene)-5-(2,4-dimethoxyphenyl)cyclohexane-1,3-dione
Catalog ID
STK320859
SMILES COc1cc(OC)ccc1C1CC(=O)/C(=c/2\[nH]c3c([nH]2)cccc3)/C(=O)C1
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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 C21H20N2O4 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O4/c1-26-13-7-8-14(19(11-13)27-2)12-9-17(24)20(18(25)10-12)21-22-15-5-3-4-6-16(15)23-21/h3-8,11-12,22-23H,9-10H2,1-2H3InChIKey
BCAQZQZHITXMRV-UHFFFAOYSA-NSynonyms
2(13dihydro2Hbenzimidazol2ylidene)5(24dimethoxyphenyl)cyclohexane13dione
2(13dihydrobenzimidazol2ylidene)5(24dimethoxyphenyl)cyclohexane13dione
2(1Hbenzo(d)imidazol2(3H)ylidene)5(24dimethoxyphenyl)cyclohexane13dione
COC1=CC(=C(C=C1)C2CC(=O)C(=C3NC4=CC=CC=C4N3)C(=O)C2)OC
COc1cc(OC)ccc1C1CC(=O)C(=c2(nH)c3c((nH)2)cccc3)C(=O)C1
InChI=1SC21H20N2O4c126137814(19(1113)272)12917(24)20(18(25)1012)212215534616(15)2321h3811122223H910H212H3
MFCD09430476
ZINC000009287739
ZINC09287739
ZINC9287739
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