Vitas-M small molecule compound
(4aR,7aS)-4-(3,4-dimethoxybenzyl)-1-(3-methoxyphenyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK635741
SMILES COc1cccc(c1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)Cc1ccc(c(c1)OC)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 C22H26N2O6S MW 446.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O6S/c1-28-17-6-4-5-16(10-17)24-19-14-31(26,27)13-18(19)23(12-22(24)25)11-15-7-8-20(29-2)21(9-15)30-3/h4-10,18-19H,11-14H2,1-3H3/t18-,19+/m0/s1InChIKey
KZLRQPBUWSALTK-RBUKOAKNSA-NSynonyms
1212445-85-6(4aR7aS)4(34dimethoxybenzyl)1(3methoxyphenyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1((34dimethoxyphenyl)methyl)4(3methoxyphenyl)66dioxo4a577atetrahydro2Hthieno(34b)pyrazin3one
1212445856
COC1=C(C=C(C=C1)CN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC(=CC=C4)OC)OC
COc1cccc(c1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)Cc1ccc(c(c1)OC)OC
InChI=1SC22H26N2O6Sc1281764516(1017)24191431(2627)1318(19)23(1222(24)25)11157820(292)21(915)303h4101819H1114H213H3t1819+m0s1
MFCD18246602
ZINC000057165738
ZINC57165738
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