Vitas-M small molecule compound
ethyl 4-[N-(2-methoxy-5-nitrophenyl)-N-(methylsulfonyl)glycyl]piperazine-1-carboxylate
Catalog ID
STL101735
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)[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 C17H24N4O8S MW 444.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H24N4O8S/c1-4-29-17(23)19-9-7-18(8-10-19)16(22)12-20(30(3,26)27)14-11-13(21(24)25)5-6-15(14)28-2/h5-6,11H,4,7-10,12H2,1-3H3InChIKey
XQNVVPUZZMWYKS-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=CC(=C2)(N+)(=O)(O))OC)S(=O)(=O)C
CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)C)c1cc(ccc1OC)(N+)(=O)(O)
ETHYL4(2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETYL)PIPERAZINE1CARBOXYLATE
ethyl4(N(2methoxy5nitrophenyl)N(methylsulfonyl)glycyl)piperazine1carboxylate
InChI=1SC17H24N4O8Sc142917(23)199718(81019)16(22)1220(30(326)27)141113(21(24)25)5615(14)282h5611H471012H213H3
MFCD06627100
ZINC000013896684
ZINC13896684
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