8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-(1-phenylethyl)-1,3-dipropyl-7H-purine-2,6-quinone Formula: C19H24N4O2 MolecularWeight: 340.41946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C)C3=CC=CC=C3

InChI

InChI=1S/C19H24N4O2/c1-4-11-22-17-15(18(24)23(12-5-2)19(22)25)20-16(21-17)13(3)14-9-7-6-8-10-14/h6-10,13H,4-5,11-12H2,1-3H3,(H,20,21)