Vitas-M small molecule compound

[4-(4-fluorophenyl)piperazin-1-yl](4-nitrophenyl)methanethione

Catalog ID
STL071398
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(cc1)[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 C17H16FN3O2S MW 345.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN3O2S/c18-14-3-7-15(8-4-14)19-9-11-20(12-10-19)17(24)13-1-5-16(6-2-13)21(22)23/h1-8H,9-12H2
InChIKey
AHYYNNWYBJNWPG-UHFFFAOYSA-N
Synonyms
701237-37-8
(4(4fluorophenyl)piperazin1yl)(4nitrophenyl)methanethione
1(4FLUOROPHENYL)4((4NITROPHENYL)CARBONOTHIOYL)PIPERAZINE
701237378
C1CN(CCN1C2=CC=C(C=C2)F)C(=S)C3=CC=C(C=C3)(N+)(=O)(O)
Fc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H16FN3O2Sc18143715(8414)1991120(121019)17(24)131516(6213)21(22)23h18H912H2
MFCD03854677
ZINC000000527699
ZINC00527699
ZINC527699

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Available files

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