Vitas-M small molecule compound
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-[(2,6-dichlorobenzyl)sulfanyl]ethanone
Catalog ID
STK233460
SMILES O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CSCc1c(Cl)cccc1Cl
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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 C21H22Cl2N2O3S MW 453.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N2O3S/c22-17-2-1-3-18(23)16(17)12-29-13-21(26)25-8-6-24(7-9-25)11-15-4-5-19-20(10-15)28-14-27-19/h1-5,10H,6-9,11-14H2InChIKey
YEUYRGFOLIUPJX-UHFFFAOYSA-NSynonyms
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2((26DICHLOROBENZYL)SULFANYL)ETHANONE
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)2((26DICHLOROPHENYL)METHYLSULFANYL)ETHANONE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CSCC4=C(C=CC=C4Cl)Cl
InChI=1SC21H22Cl2N2O3Sc221721318(23)16(17)12291321(26)258624(7925)1115451920(1015)28142719h1510H691114H2
MFCD04215595
ZINC000019921217
ZINC19921217
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