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

Systemtic Name: 8-(ethenylamino)-3-methyl-7-(phenylmethyl)purine-2,6-dione Openeye Name: 7-benzyl-3-methyl-8-(vinylamino)purine-2,6-dione CAS Name: 8-(ethenylamino)-3-methyl-7-(phenylmethyl)purine-2,6-dione IUPAC Name: 7-benzyl-8-(ethenylamino)-3-methylpurine-2,6-dione Traditional Name: 7-benzyl-3-methyl-8-(vinylamino)xanthine Formula: C15H15N5O2 MolecularWeight: 297.3119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N5O2/c1-3-16-14-17-12-11(13(21)18-15(22)19(12)2)20(14)9-10-7-5-4-6-8-10/h3-8H,1,9H2,2H3,(H,16,17)(H,18,21,22)