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1H-Thieno[3,4-d]imidazol-2(3H)-one, tetrahydro-4-hydroxy-1,3-bis(phenylmethyl)-, [3aS-(3a.alpha.,4.alpha.,6a.alpha.)]-
SpectraBase Compound ID A918gsoqp9N
InChI InChI=1S/C19H20N2O2S/c22-18-17-16(13-24-18)20(11-14-7-3-1-4-8-14)19(23)21(17)12-15-9-5-2-6-10-15/h1-10,16-18,22H,11-13H2/t16-,17-,18-/m1/s1
InChIKey VVYJYOBKNNEOIS-KZNAEPCWSA-N
Mol Weight 340.44 g/mol
Molecular Formula C19H20N2O2S
Exact Mass 340.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hiuf95H8waC
Name 1H-Thieno[3,4-d]imidazol-2(3H)-one, tetrahydro-4-hydroxy-1,3-bis(phenylmethyl)-, [3aS-(3a.alpha.,4.alpha.,6a.alpha.)]-
CAS Registry Number 132203-12-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N2O2S
InChI InChI=1S/C19H20N2O2S/c22-18-17-16(13-24-18)20(11-14-7-3-1-4-8-14)19(23)21(17)12-15-9-5-2-6-10-15/h1-10,16-18,22H,11-13H2/t16-,17-,18-/m1/s1
InChIKey VVYJYOBKNNEOIS-KZNAEPCWSA-N
Molecular Weight 340.441 g/mol
SMILES O[C@@]1(SC[C@]2(N(C(N([C@@]12[H])Cc1ccccc1)=O)Cc1ccccc1)[H])[H]
SPLASH splash10-000f-9611000000-6ff3e08a79260951fe75
Source of Spectrum F-46-7674-4
Synonyms (+)-(3a.alpha.,4.alpha.,6a.alpha.)-4-tetrahydro-4-hydroxy-1,3-bis(phenylmethyl)-1H-thieno[3,4-d]imidazol-2(3H)-one (3aR,4R,6aS)-1,3-dibenzyl-4-hydroxytetrahydro-1H-thieno[3,4-d]imidazol-2(3H)-one
Wiley ID 1335155