Vitas-M small molecule compound

[4-(4-fluorophenyl)piperazin-1-yl][5-(3-nitrophenyl)furan-2-yl]methanethione

Catalog ID
STL333392
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)[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 C21H18FN3O3S MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18FN3O3S/c22-16-4-6-17(7-5-16)23-10-12-24(13-11-23)21(29)20-9-8-19(28-20)15-2-1-3-18(14-15)25(26)27/h1-9,14H,10-13H2
InChIKey
NSVRNEDPEGIHOW-UHFFFAOYSA-N
Synonyms
327076-94-8
(4(4fluorophenyl)piperazin1yl)(5(3nitrophenyl)furan2yl)methanethione
1(4FLUOROPHENYL)4((5(3NITROPHENYL)2FURYL)CARBONOTHIOYL)PIPERAZINE
327076948
C1CN(CCN1C2=CC=C(C=C2)F)C(=S)C3=CC=C(O3)C4=CC(=CC=C4)(N+)(=O)(O)
Fc1ccc(cc1)N1CCN(CC1)C(=S)c1ccc(o1)c1cccc(c1)(N+)(=O)(O)
InChI=1SC21H18FN3O3Sc22164617(7516)23101224(131123)21(29)209819(2820)1521318(1415)25(26)27h1914H1013H2
MFCD02108526
ZINC000001214194
ZINC01214194
ZINC1214194

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Available files

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