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

Systemtic Name: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-(2-oxidanylidenepropyl)purine-2,6-dione Openeye Name: 7-acetonyl-8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[[methyl-(phenylmethyl)amino]methyl]-7-(2-oxopropyl)purine-2,6-dione IUPAC Name: 8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-7-(2-oxopropyl)purine-2,6-dione Traditional Name: 7-acetonyl-8-[[benzyl(methyl)amino]methyl]-1,3-dimethyl-xanthine Formula: C19H23N5O3 MolecularWeight: 369.41762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN(C)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN(C)CC3=CC=CC=C3

InChI

InChI=1S/C19H23N5O3/c1-13(25)10-24-15(12-21(2)11-14-8-6-5-7-9-14)20-17-16(24)18(26)23(4)19(27)22(17)3/h5-9H,10-12H2,1-4H3