Vitas-M small molecule compound

1-(1,3-benzodioxol-5-ylmethyl)-4-[(3,4-diethoxyphenyl)sulfonyl]piperazine

Catalog ID
STK240113
SMILES CCOc1cc(ccc1OCC)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 C22H28N2O6S MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O6S/c1-3-27-19-8-6-18(14-22(19)28-4-2)31(25,26)24-11-9-23(10-12-24)15-17-5-7-20-21(13-17)30-16-29-20/h5-8,13-14H,3-4,9-12,15-16H2,1-2H3
InChIKey
LLTAMQYEAMMNGU-UHFFFAOYSA-N
Synonyms

1(13benzodioxol5ylmethyl)4((34diethoxyphenyl)sulfonyl)piperazine
1(13BENZODIOXOL5YLMETHYL)4(34DIETHOXYPHENYL)SULFONYLPIPERAZINE
1BENZO(13)DIOXOL5YLMETHYL4(34DIETHOXYBENZENESULFONYL)PIPERAZINE
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OCC
InChI=1SC22H28N2O6Sc1327198618(1422(19)2842)31(2526)2411923(101224)1517572021(1317)30162920h581314H349121516H212H3
MFCD07790900
ZINC000019928910
ZINC19928910

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Available files

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