6-azanyl-8-oxidanylidene-N-(oxolan-2-ylmethyl)-9-(phenylmethyl)-7H-purine-2-carboxamide

Systemtic Name: 6-azanyl-8-oxidanylidene-N-(oxolan-2-ylmethyl)-9-(phenylmethyl)-7H-purine-2-carboxamide Openeye Name: 6-amino-9-benzyl-8-oxo-N-(tetrahydrofuran-2-ylmethyl)-7H-purine-2-carboxamide CAS Name: 6-amino-8-oxo-N-(2-oxolanylmethyl)-9-(phenylmethyl)-7H-purine-2-carboxamide IUPAC Name: 6-amino-9-benzyl-8-oxo-N-(oxolan-2-ylmethyl)-7H-purine-2-carboxamide Traditional Name: 6-amino-9-benzyl-8-keto-N-(tetrahydrofurfuryl)-7H-purine-2-carboxamide Formula: C18H20N6O3 MolecularWeight: 368.3898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=NC3=C(C(=N2)N)NC(=O)N3CC4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)C2=NC3=C(C(=N2)N)NC(=O)N3CC4=CC=CC=C4

InChI

InChI=1S/C18H20N6O3/c19-14-13-16(24(18(26)21-13)10-11-5-2-1-3-6-11)23-15(22-14)17(25)20-9-12-7-4-8-27-12/h1-3,5-6,12H,4,7-10H2,(H,20,25)(H,21,26)(H2,19,22,23)