Vitas-M small molecule compound

N-benzyl-5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitroaniline

Catalog ID
STK014957
SMILES [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)S(=O)(=O)C

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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 C18H22N4O4S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O4S/c1-27(25,26)21-11-9-20(10-12-21)16-7-8-18(22(23)24)17(13-16)19-14-15-5-3-2-4-6-15/h2-8,13,19H,9-12,14H2,1H3
InChIKey
ZJLAXMKOMJPPJI-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)S(=O)(=O)C
1(METHYLSULFONYL)4(4NITRO3(BENZYLAMINO)PHENYL)PIPERAZINE
CS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CC=C3
InChI=1SC18H22N4O4Sc127(2526)2111920(101221)167818(22(23)24)17(1316)1914155324615h281319H91214H21H3
MFCD01446591
NBENZYL5(4(METHYLSULFONYL)1PIPERAZINYL)2NITROANILINE
NBENZYL5(4(METHYLSULFONYL)PIPERAZIN1YL)2NITROANILINE
NBENZYL5(4METHYLSULFONYLPIPERAZIN1YL)2NITROANILINE
STK014957
ZINC000004046655
ZINC04046655
ZINC4046655

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Available files

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