7-[(Z)-but-2-enyl]-8-(4-ethylpiperazin-1-yl)-3-methyl-purine-2,6-dione

Systemtic Name: 7-[(Z)-but-2-enyl]-8-(4-ethylpiperazin-1-yl)-3-methyl-purine-2,6-dione Openeye Name: 7-[(Z)-but-2-enyl]-8-(4-ethylpiperazin-1-yl)-3-methyl-purine-2,6-dione CAS Name: 7-[(Z)-but-2-enyl]-8-(4-ethyl-1-piperazinyl)-3-methylpurine-2,6-dione IUPAC Name: 7-[(Z)-but-2-enyl]-8-(4-ethylpiperazin-1-yl)-3-methylpurine-2,6-dione Traditional Name: 7-[(Z)-but-2-enyl]-8-(4-ethylpiperazino)-3-methyl-xanthine Formula: C16H24N6O2 MolecularWeight: 332.40076

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(N2CC=CC)C(=O)NC(=O)N3C

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(N2C/C=C\C)C(=O)NC(=O)N3C

InChI

InChI=1S/C16H24N6O2/c1-4-6-7-22-12-13(19(3)16(24)18-14(12)23)17-15(22)21-10-8-20(5-2)9-11-21/h4,6H,5,7-11H2,1-3H3,(H,18,23,24)/b6-4-