Vitas-M small molecule compound

1-[4-nitro-2-(trifluoromethyl)phenyl]-4-(phenylsulfonyl)piperazine

Catalog ID
STK017735
SMILES [O-][N+](=O)c1ccc(c(c1)C(F)(F)F)N1CCN(CC1)S(=O)(=O)c1ccccc1

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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 C17H16F3N3O4S MW 415.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F3N3O4S/c18-17(19,20)15-12-13(23(24)25)6-7-16(15)21-8-10-22(11-9-21)28(26,27)14-4-2-1-3-5-14/h1-7,12H,8-11H2
InChIKey
KCSUKIOLAFDHQY-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(c(c1)C(F)(F)F)N1CCN(CC1)S(=O)(=O)c1ccccc1
1(4NITRO2(TRIFLUOROMETHYL)PHENYL)4(PHENYLSULFONYL)PIPERAZINE
1(BENZENESULFONYL)4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZINE
1BENZENESULFONYL4(4NITRO2TRIFLUOROMETHYLPHENYL)PIPERAZINE
4(4NITRO2(TRIFLUOROMETHYL)PHENYL)1(PHENYLSULFONYL)PIPERAZINE
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))C(F)(F)F)S(=O)(=O)C3=CC=CC=C3
InChI=1SC17H16F3N3O4Sc1817(1920)151213(23(24)25)6716(15)2181022(11921)28(2627)144213514h1712H811H2
MFCD02039772
STK017735
ZINC000004543535
ZINC04543535
ZINC4543535

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Available files

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