8-bromanyl-9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine

Systemtic Name: 8-bromanyl-9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine Openeye Name: 8-bromo-9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine CAS Name: 8-bromo-9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine IUPAC Name: 8-bromo-9-ethyl-2-N-(3-phenylpropyl)purine-2,6-diamine Traditional Name: (6-amino-8-bromo-9-ethyl-purin-2-yl)-(3-phenylpropyl)amine Formula: C16H19BrN6 MolecularWeight: 375.26626

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCCCC3=CC=CC=C3)N)N=C1Br

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCCCC3=CC=CC=C3)N)N=C1Br

InChI

InChI=1S/C16H19BrN6/c1-2-23-14-12(20-15(23)17)13(18)21-16(22-14)19-10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3,(H3,18,19,21,22)