Vitas-M small molecule compound

(4aR,7aS)-1-(4-bromophenyl)-4-(3-methylbutyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide

Catalog ID
STK637732
SMILES CC(CCN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1ccc(cc1)Br)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 C17H23BrN2O3S MW 415.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23BrN2O3S/c1-12(2)7-8-19-9-17(21)20(14-5-3-13(18)4-6-14)16-11-24(22,23)10-15(16)19/h3-6,12,15-16H,7-11H2,1-2H3/t15-,16+/m0/s1
InChIKey
XZCIXOWDCALKMF-JKSUJKDBSA-N
Synonyms
1212489-84-3
(4aR7aS)1(4bromophenyl)4(3methylbutyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aR7aS)1(4bromophenyl)4isopentylhexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(4bromophenyl)1(3methylbutyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212489843
CC(C)CCN1CC(=O)N(C2C1CS(=O)(=O)C2)C3=CC=C(C=C3)Br
CC(CCN1CC(=O)N((C@H)2(C@@H)1CS(=O)(=O)C2)c1ccc(cc1)Br)C
InChI=1SC17H23BrN2O3Sc112(2)7819917(21)20(145313(18)4614)161124(2223)1015(16)19h36121516H711H212H3t1516+m0s1
MFCD18246632
ZINC000055408708
ZINC55408708

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Available files

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