Vitas-M small molecule compound
N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-2-methoxy-5-methyl-N-phenylbenzenesulfonamide
Catalog ID
STL182833
SMILES COc1ccc(cc1S(=O)(=O)N(c1ccccc1)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
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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 C28H31N3O6S MW 537.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O6S/c1-21-8-10-25(35-2)27(16-21)38(33,34)31(23-6-4-3-5-7-23)19-28(32)30-14-12-29(13-15-30)18-22-9-11-24-26(17-22)37-20-36-24/h3-11,16-17H,12-15,18-20H2,1-2H3InChIKey
AHULYCPOKBWXCF-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OC)S(=O)(=O)N(CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CC=C5
InChI=1SC28H31N3O6Sc12181025(352)27(1621)38(3334)31(236435723)1928(32)30141229(131530)18229112426(1722)37203624h3111617H12151820H212H3
MFCD06001019
N(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)2methoxy5methylNphenylbenzenesulfonamide
ZINC000059612436
ZINC59612436
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