Vitas-M small molecule compound

{4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}(3-nitrophenyl)methanone

Catalog ID
STK195049
SMILES COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)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 C18H19N3O6S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O6S/c1-27-16-5-7-17(8-6-16)28(25,26)20-11-9-19(10-12-20)18(22)14-3-2-4-15(13-14)21(23)24/h2-8,13H,9-12H2,1H3
InChIKey
RSQLEZBFPOCGQK-UHFFFAOYSA-N
Synonyms
428849-50-7
(4((4METHOXYPHENYL)SULFONYL)PIPERAZIN1YL)(3NITROPHENYL)METHANONE
(4(4METHOXYPHENYL)SULFONYLPIPERAZIN1YL)(3NITROPHENYL)METHANONE
428849507
COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H19N3O6Sc127165717(8616)28(2526)2011919(101220)18(22)1432415(1314)21(23)24h2813H912H21H3
MFCD02816762
ZINC000001178410
ZINC01178410
ZINC1178410

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Available files

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