6-chloranyl-2-(phenylmethyl)-5,7-dihydro-4H-purine

Systemtic Name: 6-chloranyl-2-(phenylmethyl)-5,7-dihydro-4H-purine Openeye Name: 2-benzyl-6-chloro-5,7-dihydro-4H-purine CAS Name: 6-chloro-2-(phenylmethyl)-5,7-dihydro-4H-purine IUPAC Name: 2-benzyl-6-chloro-5,7-dihydro-4H-purine Traditional Name: 2-benzyl-6-chloro-5,7-dihydro-4H-purine Formula: C12H11ClN4 MolecularWeight: 246.69554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3C(C(=N2)Cl)NC=N3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3C(C(=N2)Cl)NC=N3

InChI

InChI=1S/C12H11ClN4/c13-11-10-12(15-7-14-10)17-9(16-11)6-8-4-2-1-3-5-8/h1-5,7,10,12H,6H2,(H,14,15)