Vitas-M small molecule compound

1-(4-ethoxy-3-methoxybenzyl)-4-[(4-methylphenyl)sulfonyl]piperazine

Catalog ID
STK194973
SMILES CCOc1ccc(cc1OC)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)C

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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 C21H28N2O4S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O4S/c1-4-27-20-10-7-18(15-21(20)26-3)16-22-11-13-23(14-12-22)28(24,25)19-8-5-17(2)6-9-19/h5-10,15H,4,11-14,16H2,1-3H3
InChIKey
BMSUQUZOWWHKED-UHFFFAOYSA-N
Synonyms

1((4ETHOXY3METHOXYPHENYL)METHYL)4(4METHYLPHENYL)SULFONYLPIPERAZINE
1(4ETHOXY3METHOXYBENZYL)4((4METHYLPHENYL)SULFONYL)PIPERAZINE
1(4ETHOXY3METHOXYBENZYL)4(TOLUENE4SULFONYL)PIPERAZINE
CCOC1=C(C=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)OC
InChI=1SC21H28N2O4Sc14272010718(1521(20)263)1622111323(141222)28(2425)198517(2)6919h51015H4111416H213H3
MFCD02816504
ZINC000019533872
ZINC19533872

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.