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

Systemtic Name: 3-cyclopentyl-1-(cyclopropylmethyl)-7-(3-oxidanylidenebutyl)purine-2,6-dione Openeye Name: 3-cyclopentyl-1-(cyclopropylmethyl)-7-(3-oxobutyl)purine-2,6-dione CAS Name: 3-cyclopentyl-1-(cyclopropylmethyl)-7-(3-oxobutyl)purine-2,6-dione IUPAC Name: 3-cyclopentyl-1-(cyclopropylmethyl)-7-(3-oxobutyl)purine-2,6-dione Traditional Name: 3-cyclopentyl-1-(cyclopropylmethyl)-7-(3-ketobutyl)xanthine Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C=NC2=C1C(=O)N(C(=O)N2C3CCCC3)CC4CC4

Isomeric SMILES

CC(=O)CCN1C=NC2=C1C(=O)N(C(=O)N2C3CCCC3)CC4CC4

InChI

InChI=1S/C18H24N4O3/c1-12(23)8-9-20-11-19-16-15(20)17(24)21(10-13-6-7-13)18(25)22(16)14-4-2-3-5-14/h11,13-14H,2-10H2,1H3