1-[3-[[8-bromanyl-6-(dimethylamino)purin-9-yl]methyl]phenyl]urea

Systemtic Name: 1-[3-[[8-bromanyl-6-(dimethylamino)purin-9-yl]methyl]phenyl]urea Openeye Name: [3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]urea CAS Name: [3-[[8-bromo-6-(dimethylamino)-9-purinyl]methyl]phenyl]urea IUPAC Name: [3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]urea Traditional Name: [3-[[8-bromo-6-(dimethylamino)purin-9-yl]methyl]phenyl]urea Formula: C15H16BrN7O MolecularWeight: 390.23784

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC(=CC=C3)NC(=O)N)Br

Isomeric SMILES

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC(=CC=C3)NC(=O)N)Br

InChI

InChI=1S/C15H16BrN7O/c1-22(2)12-11-13(19-8-18-12)23(14(16)21-11)7-9-4-3-5-10(6-9)20-15(17)24/h3-6,8H,7H2,1-2H3,(H3,17,20,24)