Vitas-M small molecule compound
(4aR,7aS)-1-(3-methoxyphenyl)-4-(3-phenylpropyl)hexahydrothieno[3,4-b]pyrazin-2(1H)-one 6,6-dioxide
Catalog ID
STK642331
SMILES COc1cccc(c1)N1C(=O)CN([C@@H]2[C@H]1CS(=O)(=O)C2)CCCc1ccccc1
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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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-28-19-11-5-10-18(13-19)24-21-16-29(26,27)15-20(21)23(14-22(24)25)12-6-9-17-7-3-2-4-8-17/h2-5,7-8,10-11,13,20-21H,6,9,12,14-16H2,1H3/t20-,21+/m0/s1InChIKey
OUFXVFJIYUPJDD-LEWJYISDSA-NSynonyms
1212447-71-6(4aR7aS)1(3methoxyphenyl)4(3phenylpropyl)hexahydrothieno(34b)pyrazin2(1H)one66dioxide
(4aS7aR)4(3methoxyphenyl)66dioxo1(3phenylpropyl)4a577atetrahydro2Hthieno(34b)pyrazin3one
1212447716
COC1=CC=CC(=C1)N2C3CS(=O)(=O)CC3N(CC2=O)CCCC4=CC=CC=C4
COc1cccc(c1)N1C(=O)CN((C@@H)2(C@H)1CS(=O)(=O)C2)CCCc1ccccc1
InChI=1SC22H26N2O4Sc128191151018(1319)24211629(2627)1520(21)23(1422(24)25)1269177324817h25781011132021H69121416H21H3t2021+m0s1
MFCD18246711
ZINC000057176032
ZINC57176032
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