Vitas-M small molecule compound

5-[4-(benzylsulfonyl)piperazin-1-yl]-2-nitro-N-(tetrahydrofuran-2-ylmethyl)aniline

Catalog ID
STK157773
SMILES [O-][N+](=O)c1ccc(cc1NCC1CCCO1)N1CCN(CC1)S(=O)(=O)Cc1ccccc1

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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 C22H28N4O5S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5S/c27-26(28)22-9-8-19(15-21(22)23-16-20-7-4-14-31-20)24-10-12-25(13-11-24)32(29,30)17-18-5-2-1-3-6-18/h1-3,5-6,8-9,15,20,23H,4,7,10-14,16-17H2
InChIKey
GVBXXSSWXJVMGF-UHFFFAOYSA-N
Synonyms
591736-50-4
5(4(benzylsulfonyl)piperazin1yl)2nitroN((tetrahydrofuran2yl)methyl)aniline
5(4(BENZYLSULFONYL)PIPERAZIN1YL)2NITRON(TETRAHYDROFURAN2YLMETHYL)ANILINE
5(4BENZYLSULFONYLPIPERAZIN1YL)2NITRON(OXOLAN2YLMETHYL)ANILINE
591736504
C1CC(OC1)CNC2=C(C=CC(=C2)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)(N+)(=O)(O)
InChI=1SC22H28N4O5Sc2726(28)229819(1521(22)23162074143120)24101225(131124)32(2930)17185213618h135689152023H4710141617H2
MFCD03693784
ZINC000009066143
ZINC000009066149

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Available files

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