1-ethyl-3,7-dimethyl-8-(pentylamino)purine-2,6-dione

Systemtic Name: 1-ethyl-3,7-dimethyl-8-(pentylamino)purine-2,6-dione Openeye Name: 1-ethyl-3,7-dimethyl-8-(pentylamino)purine-2,6-dione CAS Name: 1-ethyl-3,7-dimethyl-8-(pentylamino)purine-2,6-dione IUPAC Name: 1-ethyl-3,7-dimethyl-8-(pentylamino)purine-2,6-dione Traditional Name: 8-(amylamino)-1-ethyl-3,7-dimethyl-xanthine Formula: C14H23N5O2 MolecularWeight: 293.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=NC2=C(N1C)C(=O)N(C(=O)N2C)CC

Isomeric SMILES

CCCCCNC1=NC2=C(N1C)C(=O)N(C(=O)N2C)CC

InChI

InChI=1S/C14H23N5O2/c1-5-7-8-9-15-13-16-11-10(17(13)3)12(20)19(6-2)14(21)18(11)4/h5-9H2,1-4H3,(H,15,16)