Vitas-M small molecule compound
1-(4-{[7-(3-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino}phenyl)ethanone
Catalog ID
STK551084
SMILES CC1CCCN(C1)c1cc(Nc2ccc(cc2)C(=O)C)c(c2c1non2)[N+](=O)[O-]
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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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c1-12-4-3-9-24(11-12)17-10-16(20(25(27)28)19-18(17)22-29-23-19)21-15-7-5-14(6-8-15)13(2)26/h5-8,10,12,21H,3-4,9,11H2,1-2H3InChIKey
YUXWTVJPRYZXAT-UHFFFAOYSA-NSynonyms
799779-34-31(4((7(3methylpiperidin1yl)4nitro213benzoxadiazol5yl)amino)phenyl)ethanone
1(4((7(3methylpiperidin1yl)4nitrobenzo(c)(125)oxadiazol5yl)amino)phenyl)ethanone
799779343
CC1CCCN(C1)c1cc(Nc2ccc(cc2)C(=O)C)c(c2c1non2)(N+)(=O)(O)
CC1CCCN(C1)C2=CC(=C(C3=NON=C23)(N+)(=O)(O))NC4=CC=C(C=C4)C(=O)C
InChI=1SC20H21N5O4c11243924(1112)171016(20(25(27)28)1918(17)22292319)21157514(6815)13(2)26h58101221H34911H212H3
MFCD03673633
ZINC000005024381
ZINC000005024382
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