9-(oxan-2-yl)-6-[(phenylmethyl)amino]-7,8-dihydropurine-2-carbonitrile

Systemtic Name: 9-(oxan-2-yl)-6-[(phenylmethyl)amino]-7,8-dihydropurine-2-carbonitrile Openeye Name: 6-(benzylamino)-9-tetrahydropyran-2-yl-7,8-dihydropurine-2-carbonitrile CAS Name: 9-(2-oxanyl)-6-[(phenylmethyl)amino]-7,8-dihydropurine-2-carbonitrile IUPAC Name: 6-(benzylamino)-9-(oxan-2-yl)-7,8-dihydropurine-2-carbonitrile Traditional Name: 6-(benzylamino)-9-tetrahydropyran-2-yl-7,8-dihydropurine-2-carbonitrile Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)N2CNC3=C2N=C(N=C3NCC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCOC(C1)N2CNC3=C2N=C(N=C3NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C18H20N6O/c19-10-14-22-17(20-11-13-6-2-1-3-7-13)16-18(23-14)24(12-21-16)15-8-4-5-9-25-15/h1-3,6-7,15,21H,4-5,8-9,11-12H2,(H,20,22,23)