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2-(4,5-diphenyl-1,3-dithiol-2-ylidene)-5-(4-methoxyphenyl)-7-phenyl-5H-thiazolo[3,2-a]pyrimidin-3-one
SpectraBase Compound ID GMiqBcKoNeK
InChI InChI=1S/C34H24N2O2S3/c1-38-26-19-17-23(18-20-26)28-21-27(22-11-5-2-6-12-22)35-34-36(28)32(37)31(41-34)33-39-29(24-13-7-3-8-14-24)30(40-33)25-15-9-4-10-16-25/h2-21,28H,1H3
InChIKey LRWDFUJBFCNRDF-UHFFFAOYSA-N
Mol Weight 588.8 g/mol
Molecular Formula C34H24N2O2S3
Exact Mass 588.099992 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hx1mtvpMyrj
Name 2-(4,5-diphenyl-1,3-dithiol-2-ylidene)-5-(4-methoxyphenyl)-7-phenyl-5H-thiazolo[3,2-a]pyrimidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H24N2O2S3
InChI InChI=1S/C34H24N2O2S3/c1-38-26-19-17-23(18-20-26)28-21-27(22-11-5-2-6-12-22)35-34-36(28)32(37)31(41-34)33-39-29(24-13-7-3-8-14-24)30(40-33)25-15-9-4-10-16-25/h2-21,28H,1H3
InChIKey LRWDFUJBFCNRDF-UHFFFAOYSA-N
Molecular Weight 588.758 g/mol
SMILES C1=C(c2ccccc2)N=C2N(C(=O)C(=C3SC(c4ccccc4)=C(c4ccccc4)S3)S2)C1c1ccc(cc1)OC
SPLASH splash10-0002-1590000000-b6fbedfe838fb74d8389
Synonyms 2-(4,5-diphenyl-1,3-dithiol-2-ylidene)-5-(4-methoxyphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-one
Wiley ID 1444358