Vitas-M small molecule compound
(2Z)-1H-benzimidazol-2-yl(8-ethoxy-4,4,6-trimethyl-2-oxo-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene)ethanenitrile
Catalog ID
STK209920
SMILES CCOc1cc2C(C)CC(N3c2c(c1)/C(=C(/c1nc2c([nH]1)cccc2)\C#N)/C3=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 C25H24N4O2 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O2/c1-5-31-15-10-16-14(2)12-25(3,4)29-22(16)17(11-15)21(24(29)30)18(13-26)23-27-19-8-6-7-9-20(19)28-23/h6-11,14H,5,12H2,1-4H3,(H,27,28)/b21-18-InChIKey
BIVVOOXBFZPULP-UZYVYHOESA-NSynonyms
(2Z)1HBENZIMIDAZOL2YL(8ETHOXY446TRIMETHYL2OXO56DIHYDRO4HPYRROLO(321IJ)QUINOLIN1(2H)YLIDENE)ETHANENITRILE
(Z)2(1Hbenzo(d)imidazol2yl)2(8ethoxy446trimethyl2oxo2456tetrahydro1Hpyrrolo(321ij)quinolin1ylidene)acetonitrile
CCOC1=CC2=C3C(=C1)C(=C(C#N)C4=NC5=CC=CC=C5N4)C(=O)N3C(CC2C)(C)C
CCOc1cc2C(C)CC(N3c2c(c1)C(=C(c1nc2c((nH)1)cccc2)C#N)C3=O)(C)C
InChI=1SC25H24N4O2c153115101614(2)1225(34)2922(16)17(1115)21(24(29)30)18(1326)232719867920(19)2823h61114H512H214H3(H2728)b2118
MFCD05839455
ZINC000004741549
ZINC000004741550
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