Vitas-M small molecule compound
(4aR,7aS)-1-(3-chlorophenyl)-4-(4-methoxybenzyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK636396
SMILES COc1ccc(cc1)CN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1cccc(c1)Cl
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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 C20H21ClN2O4S MW 420.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O4S/c1-27-17-7-5-14(6-8-17)10-22-11-20(24)23(16-4-2-3-15(21)9-16)19-13-28(25,26)12-18(19)22/h2-9,18-19H,10-13H2,1H3/t18-,19+/m0/s1InChIKey
PYSHWHLUPVROSX-RBUKOAKNSA-NSynonyms
1212430-47-1(4aR7aS)1(3chlorophenyl)4(4methoxybenzyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(3chlorophenyl)1((4methoxyphenyl)methyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212430471
COC1=CC=C(C=C1)CN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC(=CC=C4)Cl
COc1ccc(cc1)CN1CC(=O)N((C@H)2(C@@H)1CS(=O)(=O)C2)c1cccc(c1)Cl
InChI=1SC20H21ClN2O4Sc127177514(6817)10221120(24)23(1642315(21)916)191328(2526)1218(19)22h291819H1013H21H3t1819+m0s1
MFCD18246610
ZINC000055408488
ZINC55408488
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