Vitas-M small molecule compound

1-{4-[(4-fluorophenyl)sulfonyl]piperazin-1-yl}-2-(3-methyl-4-nitrophenoxy)ethanone

Catalog ID
STK461986
SMILES Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)COc1ccc(c(c1)C)[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 C19H20FN3O6S MW 437.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN3O6S/c1-14-12-16(4-7-18(14)23(25)26)29-13-19(24)21-8-10-22(11-9-21)30(27,28)17-5-2-15(20)3-6-17/h2-7,12H,8-11,13H2,1H3
InChIKey
IMHZTJNIUHERQK-UHFFFAOYSA-N
Synonyms

1(4((4fluorophenyl)sulfonyl)piperazin1yl)2(3methyl4nitrophenoxy)ethanone
1(4((4FLUOROPHENYL)SULFONYL)PIPERAZINYL)2(3METHYL4NITROPHENOXY)ETHAN1ONE
1(4(4FLUOROPHENYL)SULFONYLPIPERAZIN1YL)2(3METHYL4NITROPHENOXY)ETHANONE
CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)(N+)(=O)(O)
Fc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)COc1ccc(c(c1)C)(N+)(=O)(O)
InChI=1SC19H20FN3O6Sc1141216(4718(14)23(25)26)291319(24)2181022(11921)30(2728)175215(20)3617h2712H81113H21H3
MFCD06004451
ZINC000001054295
ZINC01054295
ZINC1054295

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Available files

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