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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > (1r,5s)-7-[4-(4-cyanophenyl)phenyl]-n-cyclohexyl-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide

Preferred term

(1r,5s)-7-[4-(4-cyanophenyl)phenyl]-n-cyclohexyl-3,6-diazabicyclo[3.1.1]heptane-6-carboxamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C25H28N4O

inchi

  • InChI=1S/C25H28N4O/c26-14-17-6-8-18(9-7-17)19-10-12-20(13-11-19)24-22-15-27-16-23(24)29(22)25(30)28-21-4-2-1-3-5-21/h6-13,21-24,27H,1-5,15-16H2,(H,28,30)/t22-,23+,24?

inchikey

  • AVQSPESFKIDNPH-VSGJHWFKSA-N

mass

  • 400.517

monoisotopicmass

  • 400.22631

smiles

  • C1CCC(CC1)NC(=O)N2[C@@H]3CNC[C@H]2C3C4=CC=C(C=C4)C5=CC=C(C=C5)C#N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:125924

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