Vitas-M small molecule compound
(2E)-1H-benzimidazol-2-yl(8-methoxy-4,4,6-trimethyl-2-oxo-4H-pyrrolo[3,2,1-ij]quinolin-1(2H)-ylidene)ethanenitrile
Catalog ID
STK167544
SMILES COc1cc2/C(=C(\c3nc4c([nH]3)cccc4)/C#N)/C(=O)N3c2c(c1)C(=CC3(C)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 C24H20N4O2 MW 396.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O2/c1-13-11-24(2,3)28-21-15(13)9-14(30-4)10-16(21)20(23(28)29)17(12-25)22-26-18-7-5-6-8-19(18)27-22/h5-11H,1-4H3,(H,26,27)/b20-17+InChIKey
FDKOXIXMDIEQPQ-LVZFUZTISA-NSynonyms
(2E)1HBENZIMIDAZOL2YL(8METHOXY446TRIMETHYL2OXO4HPYRROLO(321IJ)QUINOLIN1(2H)YLIDENE)ETHANENITRILE
(E)2(1Hbenzo(d)imidazol2yl)2(8methoxy446trimethyl2oxo24dihydro1Hpyrrolo(321ij)quinolin1ylidene)acetonitrile
CC1=CC(N2C3=C(C=C(C=C13)OC)C(=C(C#N)C4=NC5=CC=CC=C5N4)C2=O)(C)C
COc1cc2C(=C(c3nc4c((nH)3)cccc4)C#N)C(=O)N3c2c(c1)C(=CC3(C)C)C
InChI=1SC24H20N4O2c1131124(23)282115(13)914(304)1016(21)20(23(28)29)17(1225)222618756819(18)2722h511H14H3(H2627)b2017+
MFCD04171358
ZINC000004702851
ZINC04702851
ZINC4702851
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