Vitas-M small molecule compound
2-nitro-5-[4-(phenylsulfonyl)piperazin-1-yl]-N-{1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]ethyl}aniline
Catalog ID
STK148667
SMILES CC(C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)Nc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)c1ccccc1
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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 C28H36N4O4S MW 524.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O4S/c1-20(28-17-21-13-22(18-28)15-23(14-21)19-28)29-26-16-24(7-8-27(26)32(33)34)30-9-11-31(12-10-30)37(35,36)25-5-3-2-4-6-25/h2-8,16,20-23,29H,9-15,17-19H2,1H3/t20?,21-,22+,23-,28?InChIKey
KKYKETVAZABVDI-KWODWUSCSA-NSynonyms
2nitro5(4(phenylsulfonyl)piperazin1yl)N(1((3s5s7s)tricyclo(3311~37~)dec1yl)ethyl)aniline
CC(C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)Nc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)S(=O)(=O)c1ccccc1
MFCD02173855
ZINC000008443043
ZINC000008443044
Check stock
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Check stock on Vitas-MAvailable files
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