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1-(2-Chlorophenylmethyl)-5-(4-chlorophenylsulfonylamino)-1H-imidazole-N-(3-cyclohexylaminopropyl)-4-carboxamide
SpectraBase Compound ID hNgPl6gllu
InChI InChI=1S/C26H31Cl2N5O3S/c27-20-11-13-22(14-12-20)37(35,36)32-25-24(31-18-33(25)17-19-7-4-5-10-23(19)28)26(34)30-16-6-15-29-21-8-2-1-3-9-21/h4-5,7,10-14,18,21,29,32H,1-3,6,8-9,15-17H2,(H,30,34)
InChIKey FWYUVDMFKWRNJC-UHFFFAOYSA-N
Mol Weight 564.53 g/mol
Molecular Formula C26H31Cl2N5O3S
Exact Mass 563.152466 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CnzyA0SbOHK
Name 1-(2-Chlorophenylmethyl)-5-(4-chlorophenylsulfonylamino)-1H-imidazole-N-(3-cyclohexylaminopropyl)-4-carboxamide
Alternate Name(s) 1-(2-Chlorobenzyl)-5-(4-chlorophenylsulfonamido)-N-(3-(cyclohexylamino)propyl)-1H-imidazole-4-carboxamide 1-[(2-chlorophenyl)methyl]-5-[(4-chlorophenyl)sulfonylamino]-N-[3-(cyclohexylamino)propyl]-4-imidazolecarboxamide 1-[(2-chlorophenyl)methyl]-5-[(4-chlorophenyl)sulfonylamino]-N-[3-(cyclohexylamino)propyl]imidazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H31Cl2N5O3S
InChI InChI=1S/C26H31Cl2N5O3S/c27-20-11-13-22(14-12-20)37(35,36)32-25-24(31-18-33(25)17-19-7-4-5-10-23(19)28)26(34)30-16-6-15-29-21-8-2-1-3-9-21/h4-5,7,10-14,18,21,29,32H,1-3,6,8-9,15-17H2,(H,30,34)
InChIKey FWYUVDMFKWRNJC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200500150
Molecular Weight 564.532 g/mol
SMILES N(S(c1ccc(cc1)Cl)(=O)=O)c1[n](cnc1C(NCCCNC1CCCCC1)=O)Cc1ccccc1Cl
SPLASH splash10-004i-0910000000-fd835ce9b3374006e243
Source of Spectrum APC-338-545-6i
Wiley ID 1768652