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Concept information

Preferred term

AZ3451  

Type

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

charge

  • 0

formula

  • C30H27BrN4O3

inchi

  • InChI=1S/C30H27BrN4O3/c1-18(20-5-3-2-4-6-20)35-26-12-9-21(30(36)33-22-10-7-19(16-32)8-11-22)13-25(26)34-29(35)23-14-27-28(15-24(23)31)38-17-37-27/h7-15,18,20H,2-6,17H2,1H3,(H,33,36)/t18-/m0/s1

inchikey

  • FJAOGFGHTPYADT-SFHVURJKSA-N

mass

  • 571.475

monoisotopicmass

  • 570.12665

smiles

  • C[C@@H](C1CCCCC1)N1C2=CC=C(C=C2N=C1C1=CC2=C(OCO2)C=C1Br)C(=O)NC1=CC=C(C=C1)C#N

subset

  • 3_STAR

synonym EXACT

  • 2-(6-bromo-1,3-benzodioxol-5-yl)-N-(4-cyanophenyl)-1-[(1S)-1-cyclohexylethyl]-1H-benzimidazole-5-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:189647

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