Vitas-M small molecule compound

1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}-2,2-dimethylpropan-1-one

Catalog ID
STK091629
SMILES O=C(C(C)(C)C)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 C18H26N4O3 MW 346.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N4O3/c1-18(2,3)17(23)21-10-8-20(9-11-21)14-6-7-16(22(24)25)15(12-14)19-13-4-5-13/h6-7,12-13,19H,4-5,8-11H2,1-3H3
InChIKey
WYGQSZJKQLNWFX-UHFFFAOYSA-N
Synonyms

1(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE
1(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZINYL)22DIMETHYLPROPAN1ONE
CC(C)(C)C(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NC3CC3
InChI=1SC18H26N4O3c118(23)17(23)2110820(91121)146716(22(24)25)15(1214)19134513h67121319H45811H213H3
MFCD03146431
O=C(C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O)
STK091629
ZINC000004187893
ZINC04187893
ZINC4187893

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Available files

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