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4-(5-imino-2-oxo-3-phenyl-1-p-tolylimidazolidin-4-ylideneamino)-N-(pyrimidin-2-yl)benzenesulfonamide
SpectraBase Compound ID IrGMWe8VSPA
InChI InChI=1S/C26H21N7O3S/c1-18-8-12-21(13-9-18)32-23(27)24(33(26(32)34)20-6-3-2-4-7-20)30-19-10-14-22(15-11-19)37(35,36)31-25-28-16-5-17-29-25/h2-17,27H,1H3,(H,28,29,31)
InChIKey OEVORFRVOWYZNW-UHFFFAOYSA-N
Mol Weight 511.56 g/mol
Molecular Formula C26H21N7O3S
Exact Mass 511.142659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4dvos5OU9HN
Name 4-(5-imino-2-oxo-3-phenyl-1-p-tolylimidazolidin-4-ylideneamino)-N-(pyrimidin-2-yl)benzenesulfonamide
Alternate Name(s) 4-((5-imino-2-oxo-3-phenyl-1-(p-tolyl)imidazolidin-4-ylidene)amino)-N-(pyrimidin-2-yl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21N7O3S
InChI InChI=1S/C26H21N7O3S/c1-18-8-12-21(13-9-18)32-23(27)24(33(26(32)34)20-6-3-2-4-7-20)30-19-10-14-22(15-11-19)37(35,36)31-25-28-16-5-17-29-25/h2-17,27H,1H3,(H,28,29,31)
InChIKey OEVORFRVOWYZNW-UHFFFAOYSA-N
Molecular Weight 511.560 g/mol
SMILES N(S(c1ccc(N=C2N(C(N(C2=N)c2ccc(cc2)C)=O)c2ccccc2)cc1)(=O)=O)c1ncccn1
SPLASH splash10-0002-0900000000-2852c228927e23ff2b91
Source of Spectrum HAC-17-646-XXIa
Wiley ID 1783722