Vitas-M small molecule compound

1-[3-(4-fluorophenoxy)-5-nitrophenyl]tetrahydro-1H-thieno[3,4-b]pyrrol-2(3H)-one 5,5-dioxide

Catalog ID
STK768884
SMILES Fc1ccc(cc1)Oc1cc(cc(c1)[N+](=O)[O-])N1C(=O)CC2C1CS(=O)(=O)C2

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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 C18H15FN2O6S MW 406.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FN2O6S/c19-12-1-3-15(4-2-12)27-16-7-13(6-14(8-16)21(23)24)20-17-10-28(25,26)9-11(17)5-18(20)22/h1-4,6-8,11,17H,5,9-10H2
InChIKey
XWVBLRRMMCHTJB-UHFFFAOYSA-N
Synonyms

(3AS6AR)1(3(4FLUOROPHENOXY)5NITROPHENYL)TETRAHYDRO1HTHIENO(34B)PYRROL2(3H)ONE55DIOXIDE
1(3(4FLUOROPHENOXY)5NITROPHENYL)55DIOXO3A466ATETRAHYDRO3HTHIENO(34B)PYRROL2ONE
1(3(4fluorophenoxy)5nitrophenyl)tetrahydro1Hthieno(34b)pyrrol2(3H)one55dioxide
C1C2CS(=O)(=O)CC2N(C1=O)C3=CC(=CC(=C3)OC4=CC=C(C=C4)F)(N+)(=O)(O)
Fc1ccc(cc1)Oc1cc(cc(c1)(N+)(=O)(O))N1C(=O)CC2C1CS(=O)(=O)C2
InChI=1SC18H15FN2O6Sc19121315(4212)2716713(614(816)21(23)24)20171028(2526)911(17)518(20)22h14681117H5910H2
MFCD03408093
ZINC000001050053
ZINC000004580254

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Available files

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