Vitas-M small molecule compound
7-(azepan-1-yl)-N-benzyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Catalog ID
STL333421
SMILES [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)N1CCCCCC1
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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 C19H21N5O3 MW 367.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O3/c25-24(26)19-15(20-13-14-8-4-3-5-9-14)12-16(17-18(19)22-27-21-17)23-10-6-1-2-7-11-23/h3-5,8-9,12,20H,1-2,6-7,10-11,13H2InChIKey
LHXCHJBELZGSBZ-UHFFFAOYSA-NSynonyms
354148-69-9(O)(N+)(=O)c1c(NCc2ccccc2)cc(c2c1non2)N1CCCCCC1
354148699
7(azepan1yl)Nbenzyl4nitro213benzoxadiazol5amine
7(azepan1yl)Nbenzyl4nitrobenzo(c)(125)oxadiazol5amine
C1CCCN(CC1)C2=CC(=C(C3=NON=C23)(N+)(=O)(O))NCC4=CC=CC=C4
InChI=1SC19H21N5O3c2524(26)1915(2013148435914)1216(1718(19)22272117)231061271123h35891220H1267101113H2
MFCD01306934
ZINC000004020622
ZINC04020622
ZINC4020622
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