1-methyl-8-[[(2S)-oxolan-2-yl]methylamino]-3-phenyl-7H-purine-2,6-dione

Systemtic Name: 1-methyl-8-[[(2S)-oxolan-2-yl]methylamino]-3-phenyl-7H-purine-2,6-dione Openeye Name: 1-methyl-3-phenyl-8-[[(2S)-tetrahydrofuran-2-yl]methylamino]-7H-purine-2,6-dione CAS Name: 1-methyl-8-[[(2S)-2-oxolanyl]methylamino]-3-phenyl-7H-purine-2,6-dione IUPAC Name: 1-methyl-8-[[(2S)-oxolan-2-yl]methylamino]-3-phenyl-7H-purine-2,6-dione Traditional Name: 1-methyl-3-phenyl-8-[[(2S)-tetrahydrofuran-2-yl]methylamino]-7H-purine-2,6-quinone Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C(N2)NCC3CCCO3)N(C1=O)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=C(N=C(N2)NC[C@@H]3CCCO3)N(C1=O)C4=CC=CC=C4

InChI

InChI=1S/C17H19N5O3/c1-21-15(23)13-14(22(17(21)24)11-6-3-2-4-7-11)20-16(19-13)18-10-12-8-5-9-25-12/h2-4,6-7,12H,5,8-10H2,1H3,(H2,18,19,20)/t12-/m0/s1