N-[8-oxidanylidene-9-(phenylmethyl)-7H-purin-6-yl]benzamide

Systemtic Name: N-[8-oxidanylidene-9-(phenylmethyl)-7H-purin-6-yl]benzamide Openeye Name: N-(9-benzyl-8-oxo-7H-purin-6-yl)benzamide CAS Name: N-[8-oxo-9-(phenylmethyl)-7H-purin-6-yl]benzamide IUPAC Name: N-(9-benzyl-8-oxo-7H-purin-6-yl)benzamide Traditional Name: N-(9-benzyl-8-keto-7H-purin-6-yl)benzamide Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)NC(=O)C4=CC=CC=C4)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)NC(=O)C4=CC=CC=C4)NC2=O

InChI

InChI=1S/C19H15N5O2/c25-18(14-9-5-2-6-10-14)23-16-15-17(21-12-20-16)24(19(26)22-15)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,22,26)(H,20,21,23,25)