1-(naphthalen-1-ylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile

Systemtic Name: 1-(naphthalen-1-ylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile Openeye Name: 1-(1-naphthylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile CAS Name: 1-(1-naphthalenylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile IUPAC Name: 1-(naphthalen-1-ylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile Traditional Name: 1-(1-naphthylmethylamino)-9-(2H-pyran-2-yl)-3,4-dihydro-2H-purine-2-carbonitrile Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CNN3C=C4C(NC3C#N)N(C=N4)C5C=CC=CO5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CNN3C=C4C(NC3C#N)N(C=N4)C5C=CC=CO5

InChI

InChI=1S/C22H20N6O/c23-12-20-26-22-19(24-15-27(22)21-10-3-4-11-29-21)14-28(20)25-13-17-8-5-7-16-6-1-2-9-18(16)17/h1-11,14-15,20-22,25-26H,13H2