1,3-dimethyl-8-[2-[(phenylmethyl)amino]ethylamino]-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-[2-[(phenylmethyl)amino]ethylamino]-7H-purine-2,6-dione Openeye Name: 8-[2-(benzylamino)ethylamino]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[2-[(phenylmethyl)amino]ethylamino]-7H-purine-2,6-dione IUPAC Name: 8-[2-(benzylamino)ethylamino]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[2-(benzylamino)ethylamino]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C16H20N6O2 MolecularWeight: 328.369

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NCCNCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NCCNCC3=CC=CC=C3

InChI

InChI=1S/C16H20N6O2/c1-21-13-12(14(23)22(2)16(21)24)19-15(20-13)18-9-8-17-10-11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3,(H2,18,19,20)