Vitas-M small molecule compound
5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitro-N-(prop-2-en-1-yl)aniline
Catalog ID
STK157488
SMILES C=CCNc1cc(ccc1[N+](=O)[O-])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 C14H20N4O4S MW 340.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N4O4S/c1-3-6-15-13-11-12(4-5-14(13)18(19)20)16-7-9-17(10-8-16)23(2,21)22/h3-5,11,15H,1,6-10H2,2H3InChIKey
OEIBEAKAHMMGTA-UHFFFAOYSA-NSynonyms
5(4(METHYLSULFONYL)PIPERAZIN1YL)2NITRON(PROP2EN1YL)ANILINE
5(4METHYLSULFONYLPIPERAZIN1YL)2NITRONPROP2ENYLANILINE
C=CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)C
CS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))NCC=C
InChI=1SC14H20N4O4Sc13615131112(4514(13)18(19)20)167917(10816)23(221)22h351115H1610H22H3
MFCD03614905
ZINC000004688172
ZINC04688172
ZINC4688172
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