Vitas-M small molecule compound
(4aR,7aS)-4-(2-chlorobenzyl)-1-(3-methoxyphenyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK645944
SMILES COc1cccc(c1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccccc1Cl
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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/c1-27-16-7-4-6-15(9-16)23-19-13-28(25,26)12-18(19)22(11-20(23)24)10-14-5-2-3-8-17(14)21/h2-9,18-19H,10-13H2,1H3/t18-,19+/m0/s1InChIKey
KPYJSIZTSIZDSF-RBUKOAKNSA-NSynonyms
1212470-81-9(4aR7aS)4(2chlorobenzyl)1(3methoxyphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1((2chlorophenyl)methyl)4(3methoxyphenyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212470819
COC1=CC=CC(=C1)N2C3CS(=O)(=O)CC3N(CC2=O)CC4=CC=CC=C4Cl
COc1cccc(c1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)Cc1ccccc1Cl
InChI=1SC20H21ClN2O4Sc1271674615(916)23191328(2526)1218(19)22(1120(23)24)1014523817(14)21h291819H1013H21H3t1819+m0s1
MFCD18246774
ZINC000057176059
ZINC57176059
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