Vitas-M small molecule compound

(3,5-dimethoxyphenyl){4-[(4-nitrophenyl)sulfonyl]piperazin-1-yl}methanone

Catalog ID
STK194554
SMILES COc1cc(OC)cc(c1)C(=O)N1CCN(CC1)S(=O)(=O)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 C19H21N3O7S MW 435.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O7S/c1-28-16-11-14(12-17(13-16)29-2)19(23)20-7-9-21(10-8-20)30(26,27)18-5-3-15(4-6-18)22(24)25/h3-6,11-13H,7-10H2,1-2H3
InChIKey
MKMMUMXVBQVINS-UHFFFAOYSA-N
Synonyms
505053-77-0
(35DIMETHOXYPHENYL)(4((4NITROPHENYL)SULFONYL)PIPERAZIN1YL)METHANONE
(35DIMETHOXYPHENYL)(4(4NITROBENZENESULFONYL)PIPERAZIN1YL)METHANONE
(35DIMETHOXYPHENYL)(4(4NITROPHENYL)SULFONYLPIPERAZIN1YL)METHANONE
505053770
COC1=CC(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)(N+)(=O)(O))OC
COc1cc(OC)cc(c1)C(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC19H21N3O7Sc128161114(1217(1316)292)19(23)207921(10820)30(2627)185315(4618)22(24)25h361113H710H212H3
MFCD02816632
ZINC000000899679
ZINC00899679
ZINC899679

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.