Vitas-M small molecule compound

N-(4-chloro-2-nitrophenyl)-N'-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}ethane-1,2-diamine

Catalog ID
STK062674
SMILES Clc1ccc(c(c1)[N+](=O)[O-])NCCNCCOc1nonc1C

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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 C13H16ClN5O4 MW 341.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClN5O4/c1-9-13(18-23-17-9)22-7-6-15-4-5-16-11-3-2-10(14)8-12(11)19(20)21/h2-3,8,15-16H,4-7H2,1H3
InChIKey
BYUJPIXKKYRUKF-UHFFFAOYSA-N
Synonyms

CC1=NON=C1OCCNCCNC2=C(C=C(C=C2)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)(N+)(=O)(O))NCCNCCOc1nonc1C
InChI=1SC13H16ClN5O4c1913(1823179)2276154516113210(14)812(11)19(20)21h2381516H47H21H3
MFCD00394691
N(4CHLORO2NITROPHENYL)N(2((4METHYL125OXADIAZOL3YL)OXY)ETHYL)ETHANE12DIAMINE
STK062674
ZINC000005361169
ZINC5361169

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.