2-deuterio-3-(phenylmethyl)purin-6-amine

Systemtic Name: 2-deuterio-3-(phenylmethyl)purin-6-amine Openeye Name: 3-benzyl-2-deuterio-purin-6-amine CAS Name: 2-deuterio-3-(phenylmethyl)-6-purinamine IUPAC Name: 3-benzyl-2-deuteriopurin-6-amine Traditional Name: (3-benzyl-2-deuterio-purin-6-yl)amine Formula: C12H11N5 MolecularWeight: 226.255402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=C3C2=NC=N3)N

Isomeric SMILES

[2H]C1=NC(=C2C(=NC=N2)N1CC3=CC=CC=C3)N

InChI

InChI=1S/C12H11N5/c13-11-10-12(15-7-14-10)17(8-16-11)6-9-4-2-1-3-5-9/h1-5,7-8H,6,13H2/i8D