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2-(1,3-Dithietan-2-ylidene)-5-(4-methoxyphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
SpectraBase Compound ID HJJncXRqNe3
InChI InChI=1S/C21H16N2O2S3/c1-25-15-9-7-14(8-10-15)17-11-16(13-5-3-2-4-6-13)22-21-23(17)19(24)18(28-21)20-26-12-27-20/h2-11,17H,12H2,1H3
InChIKey UKBVJUMDNSRTJS-UHFFFAOYSA-N
Mol Weight 424.55 g/mol
Molecular Formula C21H16N2O2S3
Exact Mass 424.037391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjqqhU2n8NG
Name 2-(1,3-Dithietan-2-ylidene)-5-(4-methoxyphenyl)-7-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O2S3
InChI InChI=1S/C21H16N2O2S3/c1-25-15-9-7-14(8-10-15)17-11-16(13-5-3-2-4-6-13)22-21-23(17)19(24)18(28-21)20-26-12-27-20/h2-11,17H,12H2,1H3
InChIKey UKBVJUMDNSRTJS-UHFFFAOYSA-N
Molecular Weight 424.551 g/mol
SMILES C1SC(=C2SC=3N(C2=O)C(c2ccc(cc2)OC)C=C(c2ccccc2)N3)S1
SPLASH splash10-00yi-6953100000-39277d10738b55b2070d
Synonyms 2-[1,3]dithietan-2-ylidene-5-(4-methoxy-phenyl)-7-phenyl-5H-thiazolo[3,2-a]pyrimidin-3-one
Wiley ID 1444339