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

Systemtic Name: 1,3-bis(cyclopropylmethyl)-7-propyl-purine-2,6-dione Openeye Name: 1,3-bis(cyclopropylmethyl)-7-propyl-purine-2,6-dione CAS Name: 1,3-bis(cyclopropylmethyl)-7-propylpurine-2,6-dione IUPAC Name: 1,3-bis(cyclopropylmethyl)-7-propylpurine-2,6-dione Traditional Name: 1,3-bis(cyclopropylmethyl)-7-propyl-xanthine Formula: C16H22N4O2 MolecularWeight: 302.37148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2CC3CC3)CC4CC4

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2CC3CC3)CC4CC4

InChI

InChI=1S/C16H22N4O2/c1-2-7-18-10-17-14-13(18)15(21)20(9-12-5-6-12)16(22)19(14)8-11-3-4-11/h10-12H,2-9H2,1H3