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(Z)-2'-[(5-Amino-3-methyl-1-phenylpyrazol-4-yl)imino]-5'-(4-nitrobenzylidene)thiazolidin-4-one
SpectraBase Compound ID 6NIo6HPTfE2
InChI InChI=1S/C20H16N6O3S/c1-12-17(18(21)25(24-12)14-5-3-2-4-6-14)22-20-23-19(27)16(30-20)11-13-7-9-15(10-8-13)26(28)29/h2-11H,21H2,1H3,(H,22,23,27)/b16-11-
InChIKey PMYIXDHJXKFANU-WJDWOHSUSA-N
Mol Weight 420.45 g/mol
Molecular Formula C20H16N6O3S
Exact Mass 420.10046 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZdDt2lY0h2
Name (Z)-2'-[(5-Amino-3-methyl-1-phenylpyrazol-4-yl)imino]-5'-(4-nitrobenzylidene)thiazolidin-4-one
Alternate Name(s) 2-[(E)-5-Amino-3-methyl-1-phenyl-1H-pyrazol-4-ylimino]-5-[1-(4-nitro-phenyl)-meth-(Z)-ylidene]-thiazolidin-4-one (5Z)-2-[(5-amino-3-methyl-1-phenyl-4-pyrazolyl)amino]-5-[(4-nitrophenyl)methylidene]-4-thiazolone (5Z)-2-[(5-amino-3-methyl-1-phenylpyrazol-4-yl)amino]-5-[(4-nitrophenyl)methylidene]-1,3-thiazol-4-one (5Z)-2-[(5-amino-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-[(4-nitrophenyl)methylene]thiazol-4-one (5Z)-2-[(5-azanyl-3-methyl-1-phenyl-pyrazol-4-yl)amino]-5-[(4-nitrophenyl)methylidene]-1,3-thiazol-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C20H16N6O3S
InChI InChI=1S/C20H16N6O3S/c1-12-17(18(21)25(24-12)14-5-3-2-4-6-14)22-20-23-19(27)16(30-20)11-13-7-9-15(10-8-13)26(28)29/h2-11H,21H2,1H3,(H,22,23,27)/b16-11-
InChIKey PMYIXDHJXKFANU-WJDWOHSUSA-N
Molecular Weight 420.447 g/mol
SMILES Nc1c(\N=C/2NC(\C(S2)=C\c2ccc(N(=O)=O)cc2)=O)c(n[n]1-c1ccccc1)C
SPLASH splash10-00di-0020900000-7983543dc6abfc2b14a4
Source of Spectrum Y-46-758-4a
Wiley ID 1666787