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2-(Methylsulfonyl)-3-[1'-(p-nitrophenyl)-5'-cyano-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene
SpectraBase Compound ID 6vUhuXZs1eZ
InChI InChI=1S/C16H14N4O4S2/c1-10-7-14(16(25-10)26(2,23)24)15-8-13(9-17)19(18-15)11-3-5-12(6-4-11)20(21)22/h3-7,13H,8H2,1-2H3
InChIKey BYUKMIYLTCSSHX-UHFFFAOYSA-N
Mol Weight 390.43 g/mol
Molecular Formula C16H14N4O4S2
Exact Mass 390.045647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9cepj6SAa3n
Name 2-(Methylsulfonyl)-3-[1'-(p-nitrophenyl)-5'-cyano-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N4O4S2
InChI InChI=1S/C16H14N4O4S2/c1-10-7-14(16(25-10)26(2,23)24)15-8-13(9-17)19(18-15)11-3-5-12(6-4-11)20(21)22/h3-7,13H,8H2,1-2H3
InChIKey BYUKMIYLTCSSHX-UHFFFAOYSA-N
Molecular Weight 390.432 g/mol
SMILES c1(c(S(=O)(=O)C)sc(c1)C)C1=NN(c2ccc(N(=O)=O)cc2)C(C1)C#N
SPLASH splash10-03di-0019000000-ee0895e051bfea2498e5
Source of Spectrum F9-1994-115-6
Synonyms 2-(Methylsulfonyl)-3-[1'-(p-nitrophenyl)-3'-cyano-4',5'-dihydropyrazol-3'-yl]-5-methylthiophene 3-[5-methyl-2-(methylsulfonyl)-3-thienyl]-1-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole-5-carbonitrile 5-Methyl-3-[1'-(p-nitrophenyl)-5'-cyano-4',5'-dihydropyrazol-3'-yl]-2-(methylsulfonyl)thiophene
Wiley ID 1566850