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2-{[{4-chloro[(4-methylphenyl)sulfonyl]anilino}(imino)methyl]amino}-4,6-dimethylpyrimidine
SpectraBase Compound ID IBYgg8keNdB
InChI InChI=1S/C20H20ClN5O2S/c1-13-4-10-18(11-5-13)29(27,28)26(17-8-6-16(21)7-9-17)19(22)25-20-23-14(2)12-15(3)24-20/h4-12H,1-3H3,(H2,22,23,24,25)
InChIKey WRFFRVXFYKTMRV-UHFFFAOYSA-N
Mol Weight 429.93 g/mol
Molecular Formula C20H20ClN5O2S
Exact Mass 429.102624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LqUogDRhwHE
Name 2-{[{4-chloro[(4-methylphenyl)sulfonyl]anilino}(imino)methyl]amino}-4,6-dimethylpyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClN5O2S
InChI InChI=1S/C20H20ClN5O2S/c1-13-4-10-18(11-5-13)29(27,28)26(17-8-6-16(21)7-9-17)19(22)25-20-23-14(2)12-15(3)24-20/h4-12H,1-3H3,(H2,22,23,24,25)
InChIKey WRFFRVXFYKTMRV-UHFFFAOYSA-N
Molecular Weight 429.926 g/mol
SMILES N(C(N(S(c1ccc(cc1)C)(=O)=O)c1ccc(cc1)Cl)=N)c1nc(C)cc(n1)C
SPLASH splash10-02tc-9656000000-59acc87ba7980f2b7c57
Synonyms 1-(4-Chlorophenyl)-2-(4,6-dimethyl-2-pyrimidinyl)-1-(4-methylphenyl)sulfonylguanidine 1-(4-Chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-(4-methylphenyl)sulfonyl-guanidine 1-(4-Chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-(p-tolylsulfonyl)guanidine 1-(4-Chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-tosyl-guanidine
Wiley ID 1442332