8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione

Systemtic Name: 8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione Openeye Name: 8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione CAS Name: 8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione IUPAC Name: 8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione Traditional Name: 8-[cyclopropyl(phenyl)methyl]-1,3-dipropyl-7H-purine-2,6-quinone Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C3CC3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C(C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O2/c1-3-12-24-19-17(20(26)25(13-4-2)21(24)27)22-18(23-19)16(15-10-11-15)14-8-6-5-7-9-14/h5-9,15-16H,3-4,10-13H2,1-2H3,(H,22,23)