Vitas-M small molecule compound

{4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazol-3-yl}{4-[3-(trifluoromethyl)benzyl]piperazin-1-yl}methanone

Catalog ID
STL397837
SMILES O=C(c1noc(c1Cn1nc(c(c1C)[N+](=O)[O-])C)C)N1CCN(CC1)Cc1cccc(c1)C(F)(F)F

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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 C23H25F3N6O4 MW 506.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25F3N6O4/c1-14-21(32(34)35)15(2)31(27-14)13-19-16(3)36-28-20(19)22(33)30-9-7-29(8-10-30)12-17-5-4-6-18(11-17)23(24,25)26/h4-6,11H,7-10,12-13H2,1-3H3
InChIKey
XXOGLYKVQHGOBT-UHFFFAOYSA-N
Synonyms
1006996-21-9
(4((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)5METHYL12OXAZOL3YL)(4(3(TRIFLUOROMETHYL)BENZYL)PIPERAZIN1YL)METHANONE
(4((35dimethyl4nitropyrazol1yl)methyl)5methyl12oxazol3yl)(4((3(trifluoromethyl)phenyl)methyl)piperazin1yl)methanone
1006996219
CC1=C(C(=NN1CC2=C(ON=C2C(=O)N3CCN(CC3)CC4=CC(=CC=C4)C(F)(F)F)C)C)(N+)(=O)(O)
InChI=1SC23H25F3N6O4c11421(32(34)35)15(2)31(2714)131916(3)362820(19)22(33)309729(81030)121754618(1117)23(2425)26h4611H7101213H213H3
MFCD08554271
O=C(c1noc(c1Cn1nc(c(c1C)(N+)(=O)(O))C)C)N1CCN(CC1)Cc1cccc(c1)C(F)(F)F
ZINC000022830263
ZINC22830263

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Available files

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