Vitas-M small molecule compound
2-methyl-5-[4-(methylsulfonyl)piperazin-1-yl]-4-nitroaniline
Catalog ID
STL358497
SMILES [O-][N+](=O)c1cc(C)c(cc1N1CCN(CC1)S(=O)(=O)C)N
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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 C12H18N4O4S MW 314.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O4S/c1-9-7-12(16(17)18)11(8-10(9)13)14-3-5-15(6-4-14)21(2,19)20/h7-8H,3-6,13H2,1-2H3InChIKey
DHOITVBPKXLHSV-UHFFFAOYSA-NSynonyms
593237-46-8(O)(N+)(=O)c1cc(C)c(cc1N1CCN(CC1)S(=O)(=O)C)N
2methyl5(4(methylsulfonyl)piperazin1yl)4nitroaniline
2METHYL5(4METHYLSULFONYLPIPERAZIN1YL)4NITROANILINE
593237468
CC1=CC(=C(C=C1N)N2CCN(CC2)S(=O)(=O)C)(N+)(=O)(O)
InChI=1SC12H18N4O4Sc19712(16(17)18)11(810(9)13)143515(6414)21(219)20h78H3613H212H3
MFCD03693813
ZINC000004978137
ZINC04978137
ZINC4978137
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