Vitas-M small molecule compound
N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-N-(3-bromophenyl)-4-methylbenzenesulfonamide
Catalog ID
STL113815
SMILES Brc1cccc(c1)N(S(=O)(=O)c1ccc(cc1)C)CC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C27H28BrN3O5S MW 586.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28BrN3O5S/c1-20-5-8-24(9-6-20)37(33,34)31(23-4-2-3-22(28)16-23)18-27(32)30-13-11-29(12-14-30)17-21-7-10-25-26(15-21)36-19-35-25/h2-10,15-16H,11-14,17-19H2,1H3InChIKey
XKHHPPGXZMWWFU-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC(=CC=C5)Br
InChI=1SC27H28BrN3O5Sc1205824(9620)37(3334)31(2342322(28)1623)1827(32)30131129(121430)17217102526(1521)36193525h2101516H11141719H21H3
MFCD06670444
N(2(4(13benzodioxol5ylmethyl)piperazin1yl)2oxoethyl)N(3bromophenyl)4methylbenzenesulfonamide
ZINC000059651579
ZINC59651579
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