1-cyclopentyl-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione

Systemtic Name: 1-cyclopentyl-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione Openeye Name: 1-cyclopentyl-3-(4-isopropylphenyl)-7H-purine-2,6-dione CAS Name: 1-cyclopentyl-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione IUPAC Name: 1-cyclopentyl-3-(4-propan-2-ylphenyl)-7H-purine-2,6-dione Traditional Name: 1-cyclopentyl-3-p-cumenyl-7H-purine-2,6-quinone Formula: C19H22N4O2 MolecularWeight: 338.40358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=O)C4CCCC4)NC=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C3=C(C(=O)N(C2=O)C4CCCC4)NC=N3

InChI

InChI=1S/C19H22N4O2/c1-12(2)13-7-9-15(10-8-13)22-17-16(20-11-21-17)18(24)23(19(22)25)14-5-3-4-6-14/h7-12,14H,3-6H2,1-2H3,(H,20,21)