8-(2-azanylethylamino)-3-methyl-7-(phenylmethyl)purine-2,6-dione

Systemtic Name: 8-(2-azanylethylamino)-3-methyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 8-(2-aminoethylamino)-7-benzyl-3-methyl-purine-2,6-dione CAS Name: 8-(2-aminoethylamino)-3-methyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 8-(2-aminoethylamino)-7-benzyl-3-methylpurine-2,6-dione Traditional Name: 8-(2-aminoethylamino)-7-benzyl-3-methyl-xanthine Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCN)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCN)CC3=CC=CC=C3

InChI

InChI=1S/C15H18N6O2/c1-20-12-11(13(22)19-15(20)23)21(14(18-12)17-8-7-16)9-10-5-3-2-4-6-10/h2-6H,7-9,16H2,1H3,(H,17,18)(H,19,22,23)