N-(4-bromanyl-3-methyl-phenyl)-7H-purin-6-amine

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-7H-purin-6-amine Openeye Name: N-(4-bromo-3-methyl-phenyl)-7H-purin-6-amine CAS Name: N-(4-bromo-3-methylphenyl)-7H-purin-6-amine IUPAC Name: N-(4-bromo-3-methylphenyl)-7H-purin-6-amine Traditional Name: (4-bromo-3-methyl-phenyl)-(7H-purin-6-yl)amine Formula: C12H10BrN5 MolecularWeight: 304.1453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=NC=NC3=C2NC=N3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=NC=NC3=C2NC=N3)Br

InChI

InChI=1S/C12H10BrN5/c1-7-4-8(2-3-9(7)13)18-12-10-11(15-5-14-10)16-6-17-12/h2-6H,1H3,(H2,14,15,16,17,18)