Vitas-M small molecule compound

2-{5-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]pentyl}-1H-isoindole-1,3(2H)-dione

Catalog ID
STK321660
SMILES [O-][N+](=O)c1cccc(c1)c1noc(n1)CCCCCN1C(=O)c2c(C1=O)cccc2

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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 C21H18N4O5 MW 406.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O5/c26-20-16-9-3-4-10-17(16)21(27)24(20)12-5-1-2-11-18-22-19(23-30-18)14-7-6-8-15(13-14)25(28)29/h3-4,6-10,13H,1-2,5,11-12H2
InChIKey
WIVQGTVFNXIXAU-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)c1noc(n1)CCCCCN1C(=O)c2c(C1=O)cccc2
2(5(3(3nitrophenyl)124oxadiazol5yl)pentyl)1Hisoindole13(2H)dione
2(5(3(3NITROPHENYL)124OXADIAZOL5YL)PENTYL)ISOINDOLE13DIONE
C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCC3=NC(=NO3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC21H18N4O5c2620169341017(16)21(27)24(20)1251211182219(233018)1476815(1314)25(28)29h3461013H1251112H2
MFCD06667986
ZINC000012653984
ZINC12653984

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Available files

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