1,3-dimethyl-7-[1-(4-prop-2-enylpiperazin-1-yl)propyl]purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-[1-(4-prop-2-enylpiperazin-1-yl)propyl]purine-2,6-dione Openeye Name: 7-[1-(4-allylpiperazin-1-yl)propyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 1,3-dimethyl-7-[1-(4-prop-2-enyl-1-piperazinyl)propyl]purine-2,6-dione IUPAC Name: 1,3-dimethyl-7-[1-(4-prop-2-enylpiperazin-1-yl)propyl]purine-2,6-dione Traditional Name: 7-[1-(4-allylpiperazino)propyl]-1,3-dimethyl-xanthine Formula: C17H26N6O2 MolecularWeight: 346.42734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCN(CC1)CC=C)N2C=NC3=C2C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCC(N1CCN(CC1)CC=C)N2C=NC3=C2C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C17H26N6O2/c1-5-7-21-8-10-22(11-9-21)13(6-2)23-12-18-15-14(23)16(24)20(4)17(25)19(15)3/h5,12-13H,1,6-11H2,2-4H3