Vitas-M small molecule compound

6-ethyl-7-hydroxy-3-(1-methyl-1H-benzimidazol-2-yl)-2-(4-nitrophenyl)-4H-chromen-4-one

Catalog ID
STK639502
SMILES CCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(n1C)cccc2)c1ccc(cc1)[N+](=O)[O-]

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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 C25H19N3O5 MW 441.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O5/c1-3-14-12-17-21(13-20(14)29)33-24(15-8-10-16(11-9-15)28(31)32)22(23(17)30)25-26-18-6-4-5-7-19(18)27(25)2/h4-13,29H,3H2,1-2H3
InChIKey
KBRVVCXHDHCACU-UHFFFAOYSA-N
Synonyms
315237-58-2
6ETHYL7HYDROXY3(1METHYL1H13BENZODIAZOL2YL)2(4NITROPHENYL)4HCHROMEN4ONE
6ethyl7hydroxy3(1methyl1Hbenzimidazol2yl)2(4nitrophenyl)4Hchromen4one
6ethyl7hydroxy3(1methyl1Hbenzo(d)imidazol2yl)2(4nitrophenyl)4Hchromen4one
6ETHYL7HYDROXY3(1METHYLBENZIMIDAZOL2YL)2(4NITROPHENYL)CHROMEN4ONE
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C4=NC5=CC=CC=C5N4C)O
CCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(n1C)cccc2)c1ccc(cc1)(N+)(=O)(O)
Registry IDs
MFCD00594067
ZINC000013233172
ZINC13233172

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Available files

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