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[3,5-Bis(4-methylphenylthio)-4H-1,2,6-thiadiazin-4-ylidene]propanedinitrile
SpectraBase Compound ID 5KOLIfm560p
InChI InChI=1S/C20H14N4S3/c1-13-3-7-16(8-4-13)25-19-18(15(11-21)12-22)20(24-27-23-19)26-17-9-5-14(2)6-10-17/h3-10H,1-2H3
InChIKey RJDJLEJULPZWAM-UHFFFAOYSA-N
Mol Weight 406.54 g/mol
Molecular Formula C20H14N4S3
Exact Mass 406.03806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4H05fAocQes
Name [3,5-Bis(4-methylphenylthio)-4H-1,2,6-thiadiazin-4-ylidene]propanedinitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N4S3
InChI InChI=1S/C20H14N4S3/c1-13-3-7-16(8-4-13)25-19-18(15(11-21)12-22)20(24-27-23-19)26-17-9-5-14(2)6-10-17/h3-10H,1-2H3
InChIKey RJDJLEJULPZWAM-UHFFFAOYSA-N
Molecular Weight 406.540 g/mol
SMILES C1(C(=NSN=C1Sc1ccc(cc1)C)Sc1ccc(cc1)C)=C(C#N)C#N
SPLASH splash10-05bf-9511400000-312ca7417326879cc485
Source of Spectrum KC-0-1085-4
Synonyms 2-{3,5-bis[(4-methylphenyl)sulfanyl]-4H-1,2,6-thiadiazin-4-ylidene}malononitrile 2-[3,5-bis[(4-methylphenyl)thio]-1,2,6-thiadiazin-4-ylidene]propanedinitrile 2-[3,5-bis(p-tolylsulfanyl)-1,2,6-thiadiazin-4-ylidene]propanedinitrile 2-[3,5-bis[(4-methylphenyl)sulfanyl]-1,2,6-thiadiazin-4-ylidene]propanedinitrile
Wiley ID 830290