6-azanylidene-9-(phenylmethyl)purin-1-amine

Systemtic Name: 6-azanylidene-9-(phenylmethyl)purin-1-amine Openeye Name: 9-benzyl-6-imino-purin-1-amine CAS Name: 6-imino-9-(phenylmethyl)-1-purinamine IUPAC Name: 9-benzyl-6-iminopurin-1-amine Traditional Name: (9-benzyl-6-imino-purin-1-yl)amine Formula: C12H12N6 MolecularWeight: 240.26388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN(C3=N)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN(C3=N)N

InChI

InChI=1S/C12H12N6/c13-11-10-12(16-8-18(11)14)17(7-15-10)6-9-4-2-1-3-5-9/h1-5,7-8,13H,6,14H2