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N-benzoyl-o-benzyl-N-(phenylsulfonyl)-2,5-diamino-4-morpholylphenol
SpectraBase Compound ID F4NYpUHvrHi
InChI InChI=1S/C30H29N3O5S/c31-26-20-27(32-16-18-37-19-17-32)28(21-29(26)38-22-23-10-4-1-5-11-23)33(30(34)24-12-6-2-7-13-24)39(35,36)25-14-8-3-9-15-25/h1-15,20-21H,16-19,22,31H2
InChIKey JHODYIJLTWTCLS-UHFFFAOYSA-N
Mol Weight 543.64 g/mol
Molecular Formula C30H29N3O5S
Exact Mass 543.182792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oBshxAEuBE
Name N-benzoyl-o-benzyl-N-(phenylsulfonyl)-2,5-diamino-4-morpholylphenol
Alternate Name(s) N-[4-amino-5-(benzyloxy)-2-(4-morpholinyl)phenyl]-N-benzoylbenzenesulfonamide
CAS Registry Number 124400-56-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H29N3O5S
InChI InChI=1S/C30H29N3O5S/c31-26-20-27(32-16-18-37-19-17-32)28(21-29(26)38-22-23-10-4-1-5-11-23)33(30(34)24-12-6-2-7-13-24)39(35,36)25-14-8-3-9-15-25/h1-15,20-21H,16-19,22,31H2
InChIKey JHODYIJLTWTCLS-UHFFFAOYSA-N
Molecular Weight 543.638 g/mol
SMILES Nc1c(cc(N(S(=O)(=O)c2ccccc2)C(=O)c2ccccc2)c(c1)N1CCOCC1)OCc1ccccc1
SPLASH splash10-0a4l-8900400000-028cef9cf58a5af6a4e2
Source of Spectrum J-55-1387-19
Wiley ID 1404949