NSC81509

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Creator
US National Cancer Institute
Publication Date
2005-08-25
Alternative Title
Benzimidazole, [2-(4-theophyllin-8-yl)butyl]-
Theophylline, 8-[4-(2-benzimidazolyl)butyl]-
WLN: T56 BM DN FNVNVJ F1 H1 C4- CT56 BM DNJ
1H-Purine-2,6-dione, 8-[4-(1H-benzimidazol-2-yl)butyl]-3,7-dihydro-1,3-dimethyl- (9CI)
8-[4-(2-Benzimidazolyl)butyl]theophylline
Publisher
Unilever Center for Molecular Informatics, Cambridge University
Language
en_GB
Type
Chemical Structures
Metadata
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Citation
Unknown author (2005). NSC81509. [chemical structure]. http://www.dspace.cam.ac.uk/handle/1810/71174
Identifiers
NSC81509
This record's URL: http://www.dspace.cam.ac.uk/handle/1810/71174
IUPAC Chemical Identifier (IChI): C18H20N6O2,1H3-23-16-15(17(25)24(2H3)18(23)26)22H-14(20-16)10H2-8H2-7H2-9H2-13-19-11-5H-3H-4H-6H-12(11)21H-13
IUPAC/NIST Chemical Identifier (INChI): InChI=1S/C18H20N6O2/c1-23-16-15(17(25)24(2)18(23)26)21-14(22-16)10-6-5-9-13-19-11-7-3-4-8-12(11)20-13/h3-4,7-8H,5-6,9-10H2,1-2H3,(H,19,20)(H,21,22)
IUPAC/NIST Chemical Identifier Key (INChI): VEFLECDGOCHYBW-UHFFFAOYSA-N