Vitas-M small molecule compound
N-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-N-(3-chloro-2-methylphenyl)benzenesulfonamide
Catalog ID
STK026381
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN(S(=O)(=O)c1ccccc1)c1cccc(c1C)Cl
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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 C27H28ClN3O5S MW 542.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClN3O5S/c1-20-23(28)8-5-9-24(20)31(37(33,34)22-6-3-2-4-7-22)18-27(32)30-14-12-29(13-15-30)17-21-10-11-25-26(16-21)36-19-35-25/h2-11,16H,12-15,17-19H2,1H3InChIKey
CMUIKAOFMQCLII-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1Cl)N(CC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5
InChI=1SC27H28ClN3O5Sc12023(28)85924(20)31(37(3334)226324722)1827(32)30141229(131530)172110112526(1621)36193525h21116H12151719H21H3
MFCD03262002
N(2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2OXOETHYL)N(3CHLORO2METHYLPHENYL)BENZENESULFONAMIDE
O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CN(S(=O)(=O)c1ccccc1)c1cccc(c1C)Cl
STK026381
ZINC000097995539
ZINC97995539
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