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Methyl 5-{4-[4-(dimethylamino)phenylazo]phenylamino}-6-chlorocyclopenta[1,2,3]dithiazole-4-carboxylate
SpectraBase Compound ID 4fFIiUCE0wQ
InChI InChI=1S/C21H18ClN5O2S2/c1-27(2)15-10-8-14(9-11-15)25-24-13-6-4-12(5-7-13)23-18-16(21(28)29-3)19-20(17(18)22)30-31-26-19/h4-11,23H,1-3H3/b25-24+
InChIKey QGEUZNMCLMCOCQ-OCOZRVBESA-N
Mol Weight 471.98 g/mol
Molecular Formula C21H18ClN5O2S2
Exact Mass 471.059045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaWMgjMmpM7
Name Methyl 5-{4-[4-(dimethylamino)phenylazo]phenylamino}-6-chlorocyclopenta[1,2,3]dithiazole-4-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClN5O2S2
InChI InChI=1S/C21H18ClN5O2S2/c1-27(2)15-10-8-14(9-11-15)25-24-13-6-4-12(5-7-13)23-18-16(21(28)29-3)19-20(17(18)22)30-31-26-19/h4-11,23H,1-3H3/b25-24+
InChIKey QGEUZNMCLMCOCQ-OCOZRVBESA-N
Molecular Weight 471.981 g/mol
SMILES N(C1=C(C=2C(=C1Cl)SSN2)C(=O)OC)c1ccc(\N=N\c2ccc(cc2)N(C)C)cc1
SPLASH splash10-00di-3940500000-4d038c7f90d60dc7cc2a
Source of Spectrum F-70-9325-32
Wiley ID 1597761