Vitas-M small molecule compound
(2E)-1-[4-(phenylsulfonyl)piperazin-1-yl]-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK257272
SMILES COc1c(/C=C/C(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)ccc(c1OC)OC
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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 C22H26N2O6S MW 446.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O6S/c1-28-19-11-9-17(21(29-2)22(19)30-3)10-12-20(25)23-13-15-24(16-14-23)31(26,27)18-7-5-4-6-8-18/h4-12H,13-16H2,1-3H3/b12-10+InChIKey
KCCBFUNRQMFUFY-ZRDIBKRKSA-NSynonyms
(2E)1(4(phenylsulfonyl)piperazin1yl)3(234trimethoxyphenyl)prop2en1one
(E)1(4(benzenesulfonyl)piperazin1yl)3(234trimethoxyphenyl)prop2en1one
COC1=C(C(=C(C=C1)C=CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)OC)OC
COc1c(C=CC(=O)N2CCN(CC2)S(=O)(=O)c2ccccc2)ccc(c1OC)OC
InChI=1SC22H26N2O6Sc1281911917(21(292)22(19)303)101220(25)23131524(161423)31(2627)187546818h412H1316H213H3b1210+
MFCD08683120
ZINC000009356112
ZINC09356112
ZINC9356112
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