Vitas-M small molecule compound
(4aR,7aS)-1-(3-chlorophenyl)-4-[2-(3,4-dimethoxyphenyl)ethyl]hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK638609
SMILES COc1cc(CCN2CC(=O)N([C@H]3[C@@H]2CS(=O)(=O)C3)c2cccc(c2)Cl)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 C22H25ClN2O5S MW 464.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O5S/c1-29-20-7-6-15(10-21(20)30-2)8-9-24-12-22(26)25(17-5-3-4-16(23)11-17)19-14-31(27,28)13-18(19)24/h3-7,10-11,18-19H,8-9,12-14H2,1-2H3/t18-,19+/m0/s1InChIKey
XFSPHDAIFKXTSL-RBUKOAKNSA-NSynonyms
1212470-72-8(4aR7aS)1(3chlorophenyl)4(2(34dimethoxyphenyl)ethyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aR7aS)1(3chlorophenyl)4(34dimethoxyphenethyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(3chlorophenyl)1(2(34dimethoxyphenyl)ethyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212470728
COC1=C(C=C(C=C1)CCN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC(=CC=C4)Cl)OC
COc1cc(CCN2CC(=O)N((C@H)3(C@@H)2CS(=O)(=O)C3)c2cccc(c2)Cl)ccc1OC
InChI=1SC22H25ClN2O5Sc129207615(1021(20)302)89241222(26)25(1753416(23)1117)191431(2728)1318(19)24h3710111819H891214H212H3t1819+m0s1
MFCD18246645
ZINC000055408507
ZINC55408507
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