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1-(4-Chlorophenylmethyl)-5-(4-chlorophenylsulfonylamino)-1H-imidazole-N-(2-cyclohexylaminoethyl)-4-carboxamide
SpectraBase Compound ID 7N9nwEBXXbT
InChI InChI=1S/C25H29Cl2N5O3S/c26-19-8-6-18(7-9-19)16-32-17-30-23(25(33)29-15-14-28-21-4-2-1-3-5-21)24(32)31-36(34,35)22-12-10-20(27)11-13-22/h6-13,17,21,28,31H,1-5,14-16H2,(H,29,33)
InChIKey QFKMMDBCLVZLCA-UHFFFAOYSA-N
Mol Weight 550.51 g/mol
Molecular Formula C25H29Cl2N5O3S
Exact Mass 549.136816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLcPS4R7usL
Name 1-(4-Chlorophenylmethyl)-5-(4-chlorophenylsulfonylamino)-1H-imidazole-N-(2-cyclohexylaminoethyl)-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H29Cl2N5O3S
InChI InChI=1S/C25H29Cl2N5O3S/c26-19-8-6-18(7-9-19)16-32-17-30-23(25(33)29-15-14-28-21-4-2-1-3-5-21)24(32)31-36(34,35)22-12-10-20(27)11-13-22/h6-13,17,21,28,31H,1-5,14-16H2,(H,29,33)
InChIKey QFKMMDBCLVZLCA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200500150
Molecular Weight 550.505 g/mol
SMILES N(S(c1ccc(cc1)Cl)(=O)=O)c1[n](cnc1C(=O)NCCNC1CCCCC1)Cc1ccc(cc1)Cl
SPLASH splash10-01t9-0920000000-e6c5cc2ab778ff1087c5
Source of Spectrum APC-338-546-6k
Synonyms 1-(4-Chlorobenzyl)-5-(4-chlorophenylsulfonamido)-N-(2-(cyclohexylamino)ethyl)-1H-imidazole-4-carboxamide 1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)sulfonylamino]-N-[2-(cyclohexylamino)ethyl]-4-imidazolecarboxamide 1-[(4-chlorophenyl)methyl]-5-[(4-chlorophenyl)sulfonylamino]-N-[2-(cyclohexylamino)ethyl]imidazole-4-carboxamide
Wiley ID 1768654