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(E)-4-ETHYL-3-OXO-5-(3,5-DIPHENYL-[1,3,4]-THIADIAZOL-2-YLIDENYL)-[1,2]-DITHIOLO-[3,4-B]-[1,4]-THIAZINE-6-THIONE
SpectraBase Compound ID 8voR32YXC4z
InChI InChI=1S/C21H15N3OS5/c1-2-23-15(20(26)28-21-16(23)19(25)29-30-21)18-24(14-11-7-4-8-12-14)22-17(27-18)13-9-5-3-6-10-13/h3-12H,2H2,1H3/b18-15+
InChIKey BPCKZPSKOBYOIL-OBGWFSINSA-N
Mol Weight 485.7 g/mol
Molecular Formula C21H15N3OS5
Exact Mass 484.981868 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3HnyYeM3jA
Name (E)-4-Ethyl-3-oxo-5-(3,5-diphenyl[1.3.4]thiadiazolo-2-ylidenyl)[1,2]dithiolo[3,4-b][1,4]thiazine-6-thione
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Formula C21H15N3OS5
InChI InChI=1S/C21H15N3OS5/c1-2-23-15(20(26)28-21-16(23)19(25)29-30-21)18-24(14-11-7-4-8-12-14)22-17(27-18)13-9-5-3-6-10-13/h3-12H,2H2,1H3/b18-15+
InChIKey BPCKZPSKOBYOIL-OBGWFSINSA-N
Molecular Weight 485.671 g/mol
SMILES C1=2N(\C(=C/3N(N=C(S3)c3ccccc3)c3ccccc3)C(SC2SSC1=O)=S)CC
SPLASH splash10-0a70-4010900000-7aed49e509d565c19ec1
Source of Spectrum J-66-5770-4
Synonyms (5E)-5-(3,5-diphenyl-1,3,4-thiadiazol-2-ylidene)-4-ethyl-6-sulfanylidene-3-dithiolo[3,4-b][1,4]thiazinone (5E)-5-(3,5-diphenyl-1,3,4-thiadiazol-2-ylidene)-4-ethyl-6-sulfanylidenedithiolo[3,4-b][1,4]thiazin-3-one (5E)-5-(3,5-diphenyl-1,3,4-thiadiazol-2-ylidene)-4-ethyl-6-sulfanylidene-[1,2]dithiolo[3,4-b][1,4]thiazin-3-one
Wiley ID 1535732