Vitas-M small molecule compound
1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-(ethylsulfonyl)piperazine
Catalog ID
STK148816
SMILES CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[N+](=O)[O-]
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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 C17H23N5O4S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N5O4S/c1-4-27(25,26)20-9-7-19(8-10-20)15-5-6-16(22(23)24)17(12-15)21-14(3)11-13(2)18-21/h5-6,11-12H,4,7-10H2,1-3H3InChIKey
FTZXOGGQBDFFKL-UHFFFAOYSA-NSynonyms
1(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)4(ETHYLSULFONYL)PIPERAZINE
1(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)4ETHYLSULFONYLPIPERAZINE
4(3(35DIMETHYLPYRAZOLYL)4NITROPHENYL)1(ETHYLSULFONYL)PIPERAZINE
CCS(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
CCS(=O)(=O)N1CCN(CC1)C2=CC(=C(C=C2)(N+)(=O)(O))N3C(=CC(=N3)C)C
InChI=1SC17H23N5O4Sc1427(2526)209719(81020)155616(22(23)24)17(1215)2114(3)1113(2)1821h561112H4710H213H3
MFCD02629891
ZINC000004687413
ZINC04687413
ZINC4687413
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