Vitas-M small molecule compound

3-{[4-(3-nitrobenzyl)piperazin-1-yl]methyl}-1H-indole

Catalog ID
STK078087
SMILES [O-][N+](=O)c1cccc(c1)CN1CCN(CC1)Cc1c[nH]c2c1cccc2

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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 C20H22N4O2 MW 350.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2/c25-24(26)18-5-3-4-16(12-18)14-22-8-10-23(11-9-22)15-17-13-21-20-7-2-1-6-19(17)20/h1-7,12-13,21H,8-11,14-15H2
InChIKey
NSJGAMJROSRJSY-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)CN1CCN(CC1)Cc1c(nH)c2c1cccc2
1(INDOL3YLMETHYL)4((3NITROPHENYL)METHYL)PIPERAZINE
3((4((3NITROPHENYL)METHYL)PIPERAZIN1YL)METHYL)1HINDOLE
3((4(3NITROBENZYL)PIPERAZIN1YL)METHYL)1HINDOLE
3(4(3NITROBENZYL)PIPERAZIN1YLMETHYL)1HINDOLE
C1CN(CCN1CC2=CC(=CC=C2)(N+)(=O)(O))CC3=CNC4=CC=CC=C43
InChI=1SC20H22N4O2c2524(26)1853416(1218)142281023(11922)1517132120721619(17)20h17121321H8111415H2
MFCD01829175
STK078087
ZINC000000865125
ZINC865125

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Available files

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