Vitas-M small molecule compound
(4aR,7aS)-4-(3,4-dimethoxybenzyl)-1-phenylhexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK642128
SMILES COc1cc(ccc1OC)CN1CC(=O)N([C@H]2[C@@H]1CS(=O)(=O)C2)c1ccccc1
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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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-27-19-9-8-15(10-20(19)28-2)11-22-12-21(24)23(16-6-4-3-5-7-16)18-14-29(25,26)13-17(18)22/h3-10,17-18H,11-14H2,1-2H3/t17-,18+/m0/s1InChIKey
IPAJWTYNGXVSFF-ZWKOTPCHSA-NSynonyms
1212461-95-4(4aR7aS)4(34dimethoxybenzyl)1phenylhexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)1((34dimethoxyphenyl)methyl)66dioxo4phenyl4a577atetrahydro2Hthieno(34b)pyrazin3one
1212461954
COC1=C(C=C(C=C1)CN2CC(=O)N(C3C2CS(=O)(=O)C3)C4=CC=CC=C4)OC
COc1cc(ccc1OC)CN1CC(=O)N((C@H)2(C@@H)1CS(=O)(=O)C2)c1ccccc1
InChI=1SC21H24N2O5Sc127199815(1020(19)282)11221221(24)23(166435716)181429(2526)1317(18)22h3101718H1114H212H3t1718+m0s1
MFCD18246706
ZINC000055408458
ZINC55408458
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