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2,12-Cyclohexylsulfamoylamine-5,6,8,9-tetrahydrodibenz[c,h]acridine
SpectraBase Compound ID LiTXlNl2WsY
InChI InChI=1S/C33H41N5O4S2/c39-43(40,35-26-7-3-1-4-8-26)37-28-17-15-22-11-13-24-19-25-14-12-23-16-18-29(21-31(23)33(25)34-32(24)30(22)20-28)38-44(41,42)36-27-9-5-2-6-10-27/h15-21,26-27,35-38H,1-14H2
InChIKey BRUXKJLKLWMZTQ-UHFFFAOYSA-N
Mol Weight 635.8 g/mol
Molecular Formula C33H41N5O4S2
Exact Mass 635.259997 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gTvOKY9oBS
Name 2,12-Cyclohexylsulfamoylamine-5,6,8,9-tetrahydrodibenz[c,h]acridine
Alternate Name(s) N-cyclohexyl-N'-(12-{[(cyclohexylamino)sulfonyl]amino}-5,6,8,9-tetrahydrodibenzo[c,h]acridin-2-yl)sulfamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H41N5O4S2
InChI InChI=1S/C33H41N5O4S2/c39-43(40,35-26-7-3-1-4-8-26)37-28-17-15-22-11-13-24-19-25-14-12-23-16-18-29(21-31(23)33(25)34-32(24)30(22)20-28)38-44(41,42)36-27-9-5-2-6-10-27/h15-21,26-27,35-38H,1-14H2
InChIKey BRUXKJLKLWMZTQ-UHFFFAOYSA-N
Molecular Weight 635.842 g/mol
SMILES N(S(NC1CCCCC1)(=O)=O)c1cc2-c3nc4-c5cc(NS(NC6CCCCC6)(=O)=O)ccc5CCc4cc3CCc2cc1
SPLASH splash10-03di-0079000000-fa87ad693fd4dcfe2cfe
Source of Spectrum F-55-4090-13
Wiley ID 837161