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2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-2,3-dihydrochromen-4-one
SpectraBase Compound ID BKEY0FOaTOa
InChI InChI=1S/C24H20N2O3S/c1-28-21-11-10-15(23-13-20(27)17-6-2-5-9-22(17)29-23)12-16(21)14-30-24-25-18-7-3-4-8-19(18)26-24/h2-12,23H,13-14H2,1H3,(H,25,26)
InChIKey FHADVQPXZQUWAV-UHFFFAOYSA-N
Mol Weight 416.5 g/mol
Molecular Formula C24H20N2O3S
Exact Mass 416.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FrMROqv1y0z
Name 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-2,3-dihydrochromen-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20N2O3S
InChI InChI=1S/C24H20N2O3S/c1-28-21-11-10-15(23-13-20(27)17-6-2-5-9-22(17)29-23)12-16(21)14-30-24-25-18-7-3-4-8-19(18)26-24/h2-12,23H,13-14H2,1H3,(H,25,26)
InChIKey FHADVQPXZQUWAV-UHFFFAOYSA-N
Molecular Weight 416.495 g/mol
SMILES [nH]1c2ccccc2nc1SCc1cc(C2Oc3ccccc3C(C2)=O)ccc1OC
SPLASH splash10-0gba-1941000000-09f801112cf355ab610c
Synonyms 2-[3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]chroman-4-one 2-[3-[(1H-benzimidazol-2-ylthio)methyl]-4-methoxy-phenyl]chroman-4-one 2-[3-[(1H-benzimidazol-2-ylthio)methyl]-4-methoxyphenyl]-3,4-dihydro-2H-1-benzopyran-4-one 2-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-2,3-dihydro-4H-chromen-4-one
Wiley ID 1452111