6-chloranyl-8-(4-methylphenyl)-7H-purine

Systemtic Name: 6-chloranyl-8-(4-methylphenyl)-7H-purine Openeye Name: 6-chloro-8-(p-tolyl)-7H-purine CAS Name: 6-chloro-8-(4-methylphenyl)-7H-purine IUPAC Name: 6-chloro-8-(4-methylphenyl)-7H-purine Traditional Name: 6-chloro-8-(p-tolyl)-7H-purine Formula: C12H9ClN4 MolecularWeight: 244.67966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(N2)C(=NC=N3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(N2)C(=NC=N3)Cl

InChI

InChI=1S/C12H9ClN4/c1-7-2-4-8(5-3-7)11-16-9-10(13)14-6-15-12(9)17-11/h2-6H,1H3,(H,14,15,16,17)