Vitas-M small molecule compound
(4aR,7aS)-1-(4-bromophenyl)-4-[2-(cyclohex-1-en-1-yl)ethyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK633455
SMILES Brc1ccc(cc1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)CCC1=CCCCC1
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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 C20H25BrN2O3S MW 453.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN2O3S/c21-16-6-8-17(9-7-16)23-19-14-27(25,26)13-18(19)22(12-20(23)24)11-10-15-4-2-1-3-5-15/h4,6-9,18-19H,1-3,5,10-14H2/t18-,19+/m0/s1InChIKey
PZPCWXHKZBJBIS-RBUKOAKNSA-NSynonyms
1212459-56-7(4aR7aS)1(4bromophenyl)4(2(cyclohex1en1yl)ethyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(4bromophenyl)1(2(cyclohexen1yl)ethyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212459567
Brc1ccc(cc1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)CCC1=CCCCC1
C1CCC(=CC1)CCN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC=C(C=C4)Br
InChI=1SC20H25BrN2O3Sc21166817(9716)23191427(2526)1318(19)22(1220(23)24)1110154213515h4691819H1351014H2t1819+m0s1
MFCD18246563
ZINC000055408685
ZINC55408685
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