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ethyl 5-(2-aminothiazol-4-yl)-4-phenyl-2-(phenylamino)thiophene-3-carboxylate
SpectraBase Compound ID 6C8yniaMST3
InChI InChI=1S/C22H19N3O2S2/c1-2-27-21(26)18-17(14-9-5-3-6-10-14)19(16-13-28-22(23)25-16)29-20(18)24-15-11-7-4-8-12-15/h3-13,24H,2H2,1H3,(H2,23,25)
InChIKey XIDJALULLSEPIE-UHFFFAOYSA-N
Mol Weight 421.53 g/mol
Molecular Formula C22H19N3O2S2
Exact Mass 421.091869 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7rv0E8JkP8
Name ethyl 5-(2-aminothiazol-4-yl)-4-phenyl-2-(phenylamino)thiophene-3-carboxylate
Appearance Pale brown powder
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Formula C22H19N3O2S2
InChI InChI=1S/C22H19N3O2S2/c1-2-27-21(26)18-17(14-9-5-3-6-10-14)19(16-13-28-22(23)25-16)29-20(18)24-15-11-7-4-8-12-15/h3-13,24H,2H2,1H3,(H2,23,25)
InChIKey XIDJALULLSEPIE-UHFFFAOYSA-N
Instrument Name Shimadzu QP-1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3999
Molecular Weight 421.533 g/mol
SMILES Nc1nc(-c2c(c(c(s2)Nc2ccccc2)C(=O)OCC)-c2ccccc2)cs1
SPLASH splash10-004i-9002000000-32d1e4cfb8f01974ed16
Source of Spectrum Y-57-2918-5b
Wiley ID 1860270