6-azanyl-3,7-bis(phenylmethyl)purin-8-one

Systemtic Name: 6-azanyl-3,7-bis(phenylmethyl)purin-8-one Openeye Name: 6-amino-3,7-dibenzyl-purin-8-one CAS Name: 6-amino-3,7-bis(phenylmethyl)-8-purinone IUPAC Name: 6-amino-3,7-dibenzylpurin-8-one Traditional Name: 6-amino-3,7-dibenzyl-purin-8-one Formula: C19H17N5O MolecularWeight: 331.37118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC(=C3C2=NC(=O)N3CC4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC(=C3C2=NC(=O)N3CC4=CC=CC=C4)N

InChI

InChI=1S/C19H17N5O/c20-17-16-18(23(13-21-17)11-14-7-3-1-4-8-14)22-19(25)24(16)12-15-9-5-2-6-10-15/h1-10,13H,11-12,20H2