Vitas-M small molecule compound

1-{(3S,4R)-4-[(4-tert-butylphenyl)sulfonyl]-1,1-dioxidotetrahydrothiophen-3-yl}-4-ethylpiperazine

Catalog ID
STK647151
SMILES CCN1CCN(CC1)[C@H]1CS(=O)(=O)C[C@@H]1S(=O)(=O)c1ccc(cc1)C(C)(C)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 C20H32N2O4S2 MW 428.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H32N2O4S2/c1-5-21-10-12-22(13-11-21)18-14-27(23,24)15-19(18)28(25,26)17-8-6-16(7-9-17)20(2,3)4/h6-9,18-19H,5,10-15H2,1-4H3/t18-,19-/m0/s1
InChIKey
ZTEKJIVUCSMFLC-OALUTQOASA-N
Synonyms
1177460-74-0
(3R4S)3((4(tertbutyl)phenyl)sulfonyl)4(4ethylpiperazin1yl)tetrahydrothiophene11dioxide
(3R4S)3(4tertbutylphenyl)sulfonyl4(4ethylpiperazin1yl)thiolane11dioxide
1((3S4R)4((4tertbutylphenyl)sulfonyl)11dioxidotetrahydrothiophen3yl)4ethylpiperazine
1177460740
CCN1CCN(CC1)(C@H)1CS(=O)(=O)C(C@@H)1S(=O)(=O)c1ccc(cc1)C(C)(C)C
CCN1CCN(CC1)C2CS(=O)(=O)CC2S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC20H32N2O4S2c1521101222(131121)181427(2324)1519(18)28(2526)178616(7917)20(23)4h691819H51015H214H3t1819m0s1
MFCD18246792
ZINC000019820981
ZINC19820981

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Available files

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