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5-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester
SpectraBase Compound ID Ihm1OoOOq8x
InChI InChI=1S/C23H19N3O5S/c1-13-18-12-19(32-21(18)26(25-13)17-7-5-4-6-8-17)20(27)24-16-10-14(22(28)30-2)9-15(11-16)23(29)31-3/h4-12H,1-3H3,(H,24,27)
InChIKey PQRKYCPZKYGHJA-UHFFFAOYSA-N
Mol Weight 449.48 g/mol
Molecular Formula C23H19N3O5S
Exact Mass 449.104542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 255lvJTWKB3
Name 5-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester
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Formula C23H19N3O5S
InChI InChI=1S/C23H19N3O5S/c1-13-18-12-19(32-21(18)26(25-13)17-7-5-4-6-8-17)20(27)24-16-10-14(22(28)30-2)9-15(11-16)23(29)31-3/h4-12H,1-3H3,(H,24,27)
InChIKey PQRKYCPZKYGHJA-UHFFFAOYSA-N
Molecular Weight 449.481 g/mol
SMILES N(C(c1sc2c(c1)c(C)n[n]2-c1ccccc1)=O)c1cc(C(=O)OC)cc(c1)C(=O)OC
SPLASH splash10-0006-5390100000-2373162dc4ce26ecd5b9
Synonyms 5-[[(3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolyl)-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazol-5-yl)carbonylamino]benzene-1,3-dicarboxylate Dimethyl 5-[(3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carbonyl)amino]benzene-1,3-dicarboxylate
Wiley ID 1443005