9-(2-bromanyl-4-propan-2-yl-phenyl)-N,N-dibutyl-2-methyl-purin-6-amine

Systemtic Name: 9-(2-bromanyl-4-propan-2-yl-phenyl)-N,N-dibutyl-2-methyl-purin-6-amine Openeye Name: 9-(2-bromo-4-isopropyl-phenyl)-N,N-dibutyl-2-methyl-purin-6-amine CAS Name: 9-(2-bromo-4-propan-2-ylphenyl)-N,N-dibutyl-2-methyl-6-purinamine IUPAC Name: 9-(2-bromo-4-propan-2-ylphenyl)-N,N-dibutyl-2-methylpurin-6-amine Traditional Name: [9-(2-bromo-4-isopropyl-phenyl)-2-methyl-purin-6-yl]-dibutyl-amine Formula: C23H32BrN5 MolecularWeight: 458.43768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3)C(C)C)Br)C

Isomeric SMILES

CCCCN(CCCC)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3)C(C)C)Br)C

InChI

InChI=1S/C23H32BrN5/c1-6-8-12-28(13-9-7-2)22-21-23(27-17(5)26-22)29(15-25-21)20-11-10-18(16(3)4)14-19(20)24/h10-11,14-16H,6-9,12-13H2,1-5H3