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2-(4,5-Diphenyl-1,3-dithiol-2-ylidene)-5-(4-methoxyphenyl)-7-(2-naphthyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
SpectraBase Compound ID 7dlwh5pTNmK
InChI InChI=1S/C38H26N2O2S3/c1-42-30-20-18-25(19-21-30)32-23-31(29-17-16-24-10-8-9-15-28(24)22-29)39-38-40(32)36(41)35(45-38)37-43-33(26-11-4-2-5-12-26)34(44-37)27-13-6-3-7-14-27/h2-23,32H,1H3
InChIKey RVAMCDKKLMTLAA-UHFFFAOYSA-N
Mol Weight 638.8 g/mol
Molecular Formula C38H26N2O2S3
Exact Mass 638.115642 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3gbGTshVdg
Name 2-(4,5-Diphenyl-1,3-dithiol-2-ylidene)-5-(4-methoxyphenyl)-7-(2-naphthyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-3(2H)-one
Alternate Name(s) 2-(4,5-Diphenyl-[1,3]dithiol-2-ylidene)-5-(4-methoxy-phenyl)-7-naphthalen-2-yl-5H-thiazolo[3,2-a]pyrimidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H26N2O2S3
InChI InChI=1S/C38H26N2O2S3/c1-42-30-20-18-25(19-21-30)32-23-31(29-17-16-24-10-8-9-15-28(24)22-29)39-38-40(32)36(41)35(45-38)37-43-33(26-11-4-2-5-12-26)34(44-37)27-13-6-3-7-14-27/h2-23,32H,1H3
InChIKey RVAMCDKKLMTLAA-UHFFFAOYSA-N
Molecular Weight 638.818 g/mol
SMILES C1=C(c2cc3c(cc2)cccc3)N=C2N(C(=O)C(=C3SC(c4ccccc4)=C(c4ccccc4)S3)S2)C1c1ccc(cc1)OC
SPLASH splash10-0002-1691000000-f07d2bad15d7b66fb79e
Wiley ID 1444354