Vitas-M small molecule compound
1-[(3,4-dimethoxyphenyl)sulfonyl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Catalog ID
STK171916
SMILES COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F
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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 C19H20F3N3O6S MW 475.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20F3N3O6S/c1-30-17-6-4-14(12-18(17)31-2)32(28,29)24-9-7-23(8-10-24)15-5-3-13(19(20,21)22)11-16(15)25(26)27/h3-6,11-12H,7-10H2,1-2H3InChIKey
WWJZFPXUIRGBDF-UHFFFAOYSA-NSynonyms
1((34DIMETHOXYPHENYL)SULFONYL)4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE
1(34DIMETHOXYPHENYL)SULFONYL4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE
COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O))OC
COc1ccc(cc1OC)S(=O)(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
InChI=1SC19H20F3N3O6Sc130176414(1218(17)312)32(2829)249723(81024)155313(19(2021)22)1116(15)25(26)27h361112H710H212H3
MFCD00116674
ZINC000008626604
ZINC08626604
ZINC8626604
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