Vitas-M small molecule compound
5-[4-(benzylsulfonyl)piperazin-1-yl]-2-nitro-N-(2-phenylethyl)aniline
Catalog ID
STK145002
SMILES [O-][N+](=O)c1ccc(cc1NCCc1ccccc1)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 C25H28N4O4S MW 480.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4S/c30-29(31)25-12-11-23(19-24(25)26-14-13-21-7-3-1-4-8-21)27-15-17-28(18-16-27)34(32,33)20-22-9-5-2-6-10-22/h1-12,19,26H,13-18,20H2InChIKey
VXFZJUOMCLZHRC-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)S(=O)(=O)Cc1ccccc1
5(4(BENZYLSULFONYL)PIPERAZIN1YL)2NITRON(2PHENYLETHYL)ANILINE
5(4(benzylsulfonyl)piperazin1yl)2nitroNphenethylaniline
5(4benzylsulfonylpiperazin1yl)2nitroN(2phenylethyl)aniline
5(4BENZYLSULFONYLPIPERAZIN1YL)2NITRONPHENETHYLANILINE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCCC3=CC=CC=C3)S(=O)(=O)CC4=CC=CC=C4
InChI=1SC25H28N4O4Sc3029(31)25121123(1924(25)261413217314821)27151728(181627)34(3233)202295261022h1121926H131820H2
MFCD02627822
ZINC000009008886
ZINC09008886
ZINC9008886
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