Vitas-M small molecule compound

N-(2-methoxy-5-nitrophenyl)-3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propanamide

Catalog ID
STK194616
SMILES COc1ccc(cc1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)[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 C21H23F3N4O4 MW 452.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F3N4O4/c1-32-19-6-5-17(28(30)31)14-18(19)25-20(29)7-8-26-9-11-27(12-10-26)16-4-2-3-15(13-16)21(22,23)24/h2-6,13-14H,7-12H2,1H3,(H,25,29)
InChIKey
RNCGOVNUHRFTPE-UHFFFAOYSA-N
Synonyms
428846-23-5
428846235
COC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F
COc1ccc(cc1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)(N+)(=O)(O)
InChI=1SC21H23F3N4O4c132196517(28(30)31)1418(19)2520(29)782691127(121026)1642315(1316)21(2223)24h261314H712H21H3(H2529)
MFCD02815763
N(2METHOXY5NITROPHENYL)3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROPANAMIDE
ZINC000009933523
ZINC9933523

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Available files

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