Vitas-M small molecule compound

(6,7-diethoxy-3-methyl-5-nitro-1-benzofuran-2-yl)(4-methylpiperazin-1-yl)methanone

Catalog ID
STL328254
SMILES CCOc1c2oc(c(c2cc(c1OCC)[N+](=O)[O-])C)C(=O)N1CCN(CC1)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 C19H25N3O6 MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O6/c1-5-26-17-14(22(24)25)11-13-12(3)15(28-16(13)18(17)27-6-2)19(23)21-9-7-20(4)8-10-21/h11H,5-10H2,1-4H3
InChIKey
KFZYUPYVMRZVKA-UHFFFAOYSA-N
Synonyms

(67diethoxy3methyl5nitro1benzofuran2yl)(4methylpiperazin1yl)methanone
(67diethoxy3methyl5nitrobenzofuran2yl)(4methylpiperazin1yl)methanonehydrochloride
CCOC1=C(C=C2C(=C(OC2=C1OCC)C(=O)N3CCN(CC3)C)C)(N+)(=O)(O)
CCOc1c2oc(c(c2cc(c1OCC)(N+)(=O)(O))C)C(=O)N1CCN(CC1)C
CCOc1c2oc(c(c2cc(c1OCC)(N+)(=O)(O))C)C(=O)N1CCN(CC1)CCl
InChI=1SC19H25N3O6c15261714(22(24)25)111312(3)15(2816(13)18(17)2762)19(23)219720(4)81021h11H510H214H3
MFCD01245651
ZINC000000771844
ZINC771844

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Available files

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