Vitas-M small molecule compound

N-benzyl-5-{4-[(3,4-dimethylphenyl)sulfonyl]piperazin-1-yl}-2-nitroaniline

Catalog ID
STK172385
SMILES [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)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 C25H28N4O4S MW 480.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4S/c1-19-8-10-23(16-20(19)2)34(32,33)28-14-12-27(13-15-28)22-9-11-25(29(30)31)24(17-22)26-18-21-6-4-3-5-7-21/h3-11,16-17,26H,12-15,18H2,1-2H3
InChIKey
VIWRQYWITDEQHB-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)C)C
CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4)C
InChI=1SC25H28N4O4Sc11981023(1620(19)2)34(3233)28141227(131528)2291125(29(30)31)24(1722)2618216435721h311161726H121518H212H3
MFCD04077125
NBENZYL5(4((34DIMETHYLPHENYL)SULFONYL)PIPERAZIN1YL)2NITROANILINE
NBENZYL5(4(34DIMETHYLPHENYL)SULFONYLPIPERAZIN1YL)2NITROANILINE
ZINC000009891976
ZINC09891976
ZINC9891976

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Available files

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