1,3,7-tris(cyclopropylmethyl)purine-2,6-dione

Systemtic Name: 1,3,7-tris(cyclopropylmethyl)purine-2,6-dione Openeye Name: 1,3,7-tris(cyclopropylmethyl)purine-2,6-dione CAS Name: 1,3,7-tris(cyclopropylmethyl)purine-2,6-dione IUPAC Name: 1,3,7-tris(cyclopropylmethyl)purine-2,6-dione Traditional Name: 1,3,7-tris(cyclopropylmethyl)xanthine Formula: C17H22N4O2 MolecularWeight: 314.38218

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN2C=NC3=C2C(=O)N(C(=O)N3CC4CC4)CC5CC5

Isomeric SMILES

C1CC1CN2C=NC3=C2C(=O)N(C(=O)N3CC4CC4)CC5CC5

InChI

InChI=1S/C17H22N4O2/c22-16-14-15(18-10-19(14)7-11-1-2-11)20(8-12-3-4-12)17(23)21(16)9-13-5-6-13/h10-13H,1-9H2