Vitas-M small molecule compound
1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}propan-1-one
Catalog ID
STK046526
SMILES CCC(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)[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 C16H22N4O3 MW 318.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N4O3/c1-2-16(21)19-9-7-18(8-10-19)13-5-6-15(20(22)23)14(11-13)17-12-3-4-12/h5-6,11-12,17H,2-4,7-10H2,1H3InChIKey
AWAQNRKDZWLJAU-UHFFFAOYSA-NSynonyms
1(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)PROPAN1ONE
CCC(=O)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
CCC(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NC3CC3
InChI=1SC16H22N4O3c1216(21)199718(81019)135615(20(22)23)14(1113)17123412h56111217H24710H21H3
MFCD03030567
STK046526
ZINC000004187764
ZINC04187764
ZINC4187764
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