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

Systemtic Name: 1-[3-(4-azanylbutylamino)propyl]-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-[3-(4-aminobutylamino)propyl]-3,7-dimethyl-purine-2,6-dione CAS Name: 1-[3-(4-aminobutylamino)propyl]-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-[3-(4-aminobutylamino)propyl]-3,7-dimethylpurine-2,6-dione Traditional Name: 1-[3-(4-aminobutylamino)propyl]-3,7-dimethyl-xanthine Formula: C14H24N6O2 MolecularWeight: 308.37936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCNCCCCN

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCNCCCCN

InChI

InChI=1S/C14H24N6O2/c1-18-10-17-12-11(18)13(21)20(14(22)19(12)2)9-5-8-16-7-4-3-6-15/h10,16H,3-9,15H2,1-2H3