2-deuterio-7-oxidanyl-3-(phenylmethyl)purin-6-imine

Systemtic Name: 2-deuterio-7-oxidanyl-3-(phenylmethyl)purin-6-imine Openeye Name: 3-benzyl-2-deuterio-7-hydroxy-purin-6-imine CAS Name: 2-deuterio-7-hydroxy-3-(phenylmethyl)-6-purinimine IUPAC Name: 3-benzyl-2-deuterio-7-hydroxypurin-6-imine Traditional Name: (3-benzyl-2-deuterio-7-hydroxy-purin-6-ylidene)amine Formula: C12H11N5O MolecularWeight: 242.254802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=N)C3=C2N=CN3O

Isomeric SMILES

[2H]C1=NC(=N)C2=C(N1CC3=CC=CC=C3)N=CN2O

InChI

InChI=1S/C12H11N5O/c13-11-10-12(15-8-17(10)18)16(7-14-11)6-9-4-2-1-3-5-9/h1-5,7-8,13,18H,6H2/i7D