Vitas-M small molecule compound
[4-(2-chloro-6-nitrophenyl)piperazin-1-yl][4-(2-methylpropoxy)phenyl]methanone
Catalog ID
STK220351
SMILES CC(COc1ccc(cc1)C(=O)N1CCN(CC1)c1c(Cl)cccc1[N+](=O)[O-])C
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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 C21H24ClN3O4 MW 417.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O4/c1-15(2)14-29-17-8-6-16(7-9-17)21(26)24-12-10-23(11-13-24)20-18(22)4-3-5-19(20)25(27)28/h3-9,15H,10-14H2,1-2H3InChIKey
NUSIDSUTVRSXJL-UHFFFAOYSA-NSynonyms
(4(2chloro6nitrophenyl)piperazin1yl)(4(2methylpropoxy)phenyl)methanone
CC(C)COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)(N+)(=O)(O)
CC(COc1ccc(cc1)C(=O)N1CCN(CC1)c1c(Cl)cccc1(N+)(=O)(O))C
InChI=1SC21H24ClN3O4c115(2)1429178616(7917)21(26)24121023(111324)2018(22)43519(20)25(27)28h3915H1014H212H3
MFCD05850109
ZINC000004749158
ZINC04749158
ZINC4749158
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