Vitas-M small molecule compound
(4aR,7aS)-1-(3-chloro-4-methoxyphenyl)-4-[2-(4-methoxyphenoxy)ethyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK643471
SMILES COc1ccc(cc1)OCCN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1ccc(c(c1)Cl)OC
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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 C22H25ClN2O6S MW 480.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O6S/c1-29-16-4-6-17(7-5-16)31-10-9-24-12-22(26)25(20-14-32(27,28)13-19(20)24)15-3-8-21(30-2)18(23)11-15/h3-8,11,19-20H,9-10,12-14H2,1-2H3/t19-,20+/m0/s1InChIKey
NTXBXKXWUBPQID-VQTJNVASSA-NSynonyms
1212483-04-9(4aR7aS)1(3chloro4methoxyphenyl)4(2(4methoxyphenoxy)ethyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(3chloro4methoxyphenyl)1(2(4methoxyphenoxy)ethyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212483049
COC1=CC=C(C=C1)OCCN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1)OCCN1CC(=O)N((C@H)2(C@@H)1CS(=O)(=O)C2)c1ccc(c(c1)Cl)OC
InChI=1SC22H25ClN2O6Sc129164617(7516)31109241222(26)25(201432(2728)1319(20)24)153821(302)18(23)1115h38111920H9101214H212H3t1920+m0s1
MFCD18246729
ZINC000036081896
ZINC36081896
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