8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine

Systemtic Name: 8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine Openeye Name: 8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine CAS Name: 8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine IUPAC Name: 8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine Traditional Name: 8-(4-bromophenyl)-5-butyl-7H-[1,2,4]triazolo[5,1-f]purine Formula: C16H15BrN6 MolecularWeight: 371.2345

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=NC=NC2=C3N1NC(=N3)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCC1=NC2=NC=NC2=C3N1NC(=N3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C16H15BrN6/c1-2-3-4-12-20-15-13(18-9-19-15)16-21-14(22-23(12)16)10-5-7-11(17)8-6-10/h5-9H,2-4H2,1H3,(H,21,22)