7-(2-ethenylphenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione

Systemtic Name: 7-(2-ethenylphenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-piperazin-1-yl-7-(2-vinylphenyl)purine-2,6-dione CAS Name: 7-(2-ethenylphenyl)-1,3-dimethyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-(2-ethenylphenyl)-1,3-dimethyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 1,3-dimethyl-8-piperazino-7-(2-vinylphenyl)xanthine Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)C4=CC=CC=C4C=C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)C4=CC=CC=C4C=C

InChI

InChI=1S/C19H22N6O2/c1-4-13-7-5-6-8-14(13)25-15-16(22(2)19(27)23(3)17(15)26)21-18(25)24-11-9-20-10-12-24/h4-8,20H,1,9-12H2,2-3H3