Vitas-M small molecule compound
(4aR,7aS)-4-[2-(2,5-dimethoxyphenyl)ethyl]-1-(4-methoxyphenyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK644857
SMILES COc1ccc(cc1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)CCc1cc(OC)ccc1OC
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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 C23H28N2O6S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O6S/c1-29-18-6-4-17(5-7-18)25-21-15-32(27,28)14-20(21)24(13-23(25)26)11-10-16-12-19(30-2)8-9-22(16)31-3/h4-9,12,20-21H,10-11,13-15H2,1-3H3/t20-,21+/m0/s1InChIKey
PWJJZUUPGPEYFB-LEWJYISDSA-NSynonyms
1212472-18-8(4aR7aS)4(2(25dimethoxyphenyl)ethyl)1(4methoxyphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aR7aS)4(25dimethoxyphenethyl)1(4methoxyphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1(2(25dimethoxyphenyl)ethyl)4(4methoxyphenyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212472188
COC1=CC=C(C=C1)N2C3CS(=O)(=O)CC3N(CC2=O)CCC4=C(C=CC(=C4)OC)OC
COc1ccc(cc1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)CCc1cc(OC)ccc1OC
InChI=1SC23H28N2O6Sc129186417(5718)25211532(2728)1420(21)24(1323(25)26)1110161219(302)8922(16)313h49122021H10111315H213H3t2021+m0s1
MFCD18246754
ZINC000055408614
ZINC55408614
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