8-bromanyl-N-ethyl-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)purin-6-amine

Systemtic Name: 8-bromanyl-N-ethyl-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)purin-6-amine Openeye Name: 8-bromo-N-ethyl-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)purin-6-amine CAS Name: 8-bromo-N-ethyl-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)-6-purinamine IUPAC Name: 8-bromo-N-ethyl-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)purin-6-amine Traditional Name: [8-bromo-9-(4-methoxyphenyl)-2-(3-phenylpropoxy)purin-6-yl]-ethyl-amine Formula: C23H24BrN5O2 MolecularWeight: 482.37296

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=C(N2C3=CC=C(C=C3)OC)Br)OCCCC4=CC=CC=C4

Isomeric SMILES

CCNC1=NC(=NC2=C1N=C(N2C3=CC=C(C=C3)OC)Br)OCCCC4=CC=CC=C4

InChI

InChI=1S/C23H24BrN5O2/c1-3-25-20-19-21(29(22(24)26-19)17-11-13-18(30-2)14-12-17)28-23(27-20)31-15-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-14H,3,7,10,15H2,1-2H3,(H,25,27,28)