N'-[9-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-purin-6-yl]-N'-ethyl-N,N-dimethyl-ethane-1,2-diamine

Systemtic Name: N'-[9-(2-bromanyl-4-propan-2-yl-phenyl)-2-methyl-purin-6-yl]-N'-ethyl-N,N-dimethyl-ethane-1,2-diamine Openeye Name: N'-[9-(2-bromo-4-isopropyl-phenyl)-2-methyl-purin-6-yl]-N'-ethyl-N,N-dimethyl-ethane-1,2-diamine CAS Name: N'-[9-(2-bromo-4-propan-2-ylphenyl)-2-methyl-6-purinyl]-N'-ethyl-N,N-dimethylethane-1,2-diamine IUPAC Name: N'-[9-(2-bromo-4-propan-2-ylphenyl)-2-methylpurin-6-yl]-N'-ethyl-N,N-dimethylethane-1,2-diamine Traditional Name: [9-(2-bromo-4-isopropyl-phenyl)-2-methyl-purin-6-yl]-(2-dimethylaminoethyl)-ethyl-amine Formula: C21H29BrN6 MolecularWeight: 445.39916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCN(C)C)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3)C(C)C)Br)C

Isomeric SMILES

CCN(CCN(C)C)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3)C(C)C)Br)C

InChI

InChI=1S/C21H29BrN6/c1-7-27(11-10-26(5)6)20-19-21(25-15(4)24-20)28(13-23-19)18-9-8-16(14(2)3)12-17(18)22/h8-9,12-14H,7,10-11H2,1-6H3