Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-4-[(3-chloro-4-ethoxyphenyl)sulfonyl]piperazine
Catalog ID
STL196376
SMILES CCOc1ccc(cc1Cl)S(=O)(=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 C20H23ClN2O5S MW 438.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN2O5S/c1-2-26-18-6-4-16(12-17(18)21)29(24,25)23-9-7-22(8-10-23)13-15-3-5-19-20(11-15)28-14-27-19/h3-6,11-12H,2,7-10,13-14H2,1H3InChIKey
HGAJOOBAVPXOHK-UHFFFAOYSA-NSynonyms
1(13benzodioxol5ylmethyl)4((3chloro4ethoxyphenyl)sulfonyl)piperazine
1(13BENZODIOXOL5YLMETHYL)4(3CHLORO4ETHOXYPHENYL)SULFONYLPIPERAZINE
1BENZO(13)DIOXOL5YLMETHYL4(3CHLORO4ETHOXYBENZENESULFONYL)PIPERAZINE
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)Cl
InChI=1SC20H23ClN2O5Sc1226186416(1217(18)21)29(2425)239722(81023)1315351920(1115)28142719h361112H27101314H21H3
MFCD07395054
ZINC000013119441
ZINC13119441
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