Vitas-M small molecule compound

N-(2,6-dibromo-4-nitrophenyl)-2-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)acetamide

Catalog ID
STK693191
SMILES O=C(Nc1c(Br)cc(cc1Br)[N+](=O)[O-])CN1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C19H18Br2N4O4 MW 526.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Br2N4O4/c20-14-5-13(25(28)29)6-15(21)19(14)22-17(26)10-23-7-11-4-12(9-23)16-2-1-3-18(27)24(16)8-11/h1-3,5-6,11-12H,4,7-10H2,(H,22,26)
InChIKey
PKSIRCNAOOFKFO-UHFFFAOYSA-N
Synonyms

C1C2CN(CC1C3=CC=CC(=O)N3C2)CC(=O)NC4=C(C=C(C=C4Br)(N+)(=O)(O))Br
InChI=1SC19H18Br2N4O4c2014513(25(28)29)615(21)19(14)2217(26)1023711412(923)1621318(27)24(16)811h13561112H4710H2(H2226)
MFCD10039264
N(26dibromo4nitrophenyl)2(8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)acetamide
O=C(Nc1c(Br)cc(cc1Br)(N+)(=O)(O))CN1CC2CC(C1)c1n(C2)c(=O)ccc1
ZINC000100239038

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Available files

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