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2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
SpectraBase Compound ID 36bTxHBiE8v
InChI InChI=1S/C23H18N4OS2/c28-22-20-15-9-6-12-18(15)30-21(20)26-23(27(22)14-7-2-1-3-8-14)29-13-19-24-16-10-4-5-11-17(16)25-19/h1-5,7-8,10-11H,6,9,12-13H2,(H,24,25)
InChIKey MBAYPCAOGXLJOB-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C23H18N4OS2
Exact Mass 430.092204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JyGIwhdo6mf
Name 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-phenyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18N4OS2
InChI InChI=1S/C23H18N4OS2/c28-22-20-15-9-6-12-18(15)30-21(20)26-23(27(22)14-7-2-1-3-8-14)29-13-19-24-16-10-4-5-11-17(16)25-19/h1-5,7-8,10-11H,6,9,12-13H2,(H,24,25)
InChIKey MBAYPCAOGXLJOB-UHFFFAOYSA-N
Molecular Weight 430.544 g/mol
SMILES [nH]1c2ccccc2nc1CSC=1N(C(c2c(N1)sc1c2CCC1)=O)c1ccccc1
SPLASH splash10-0089-7943100000-c918598ce8f568609e8f
Synonyms 3-(1H-benzimidazol-2-ylmethylsulfanyl)-2-phenyl-7,8-dihydro-6H-cyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one
Wiley ID 1462199