Vitas-M small molecule compound
[2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}methanone
Catalog ID
STK666100
SMILES CC(=CC1C(C1(C)C)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[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 C25H33N5O3 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N5O3/c1-16(2)13-20-23(25(20,5)6)24(31)28-11-9-27(10-12-28)19-7-8-21(30(32)33)22(15-19)29-18(4)14-17(3)26-29/h7-8,13-15,20,23H,9-12H2,1-6H3InChIKey
RUGWGHHBGJIRFD-UHFFFAOYSA-NSynonyms
(22dimethyl3(2methylprop1en1yl)cyclopropyl)(4(3(35dimethyl1Hpyrazol1yl)4nitrophenyl)piperazin1yl)methanone
(22DIMETHYL3(2METHYLPROP1ENYL)CYCLOPROPYL)(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)METHANONE
CC(=CC1C(C1(C)C)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O))C
CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4C(C4(C)C)C=C(C)C)(N+)(=O)(O))C
InChI=1SC25H33N5O3c116(2)132023(25(205)6)24(31)2811927(101228)197821(30(32)33)22(1519)2918(4)1417(3)2629h7813152023H912H216H3
MFCD05860221
ZINC000012446071
ZINC000012446076
Check stock
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Check stock on Vitas-MAvailable files
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