1-[(3-chlorophenyl)methyl]-8-(hexylamino)-3-methyl-7H-purine-2,6-dione

Systemtic Name: 1-[(3-chlorophenyl)methyl]-8-(hexylamino)-3-methyl-7H-purine-2,6-dione Openeye Name: 1-[(3-chlorophenyl)methyl]-8-(hexylamino)-3-methyl-7H-purine-2,6-dione CAS Name: 1-[(3-chlorophenyl)methyl]-8-(hexylamino)-3-methyl-7H-purine-2,6-dione IUPAC Name: 1-[(3-chlorophenyl)methyl]-8-(hexylamino)-3-methyl-7H-purine-2,6-dione Traditional Name: 1-(3-chlorobenzyl)-8-(hexylamino)-3-methyl-7H-purine-2,6-quinone Formula: C19H24ClN5O2 MolecularWeight: 389.87916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC2=C(N1)C(=O)N(C(=O)N2C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCCCNC1=NC2=C(N1)C(=O)N(C(=O)N2C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H24ClN5O2/c1-3-4-5-6-10-21-18-22-15-16(23-18)24(2)19(27)25(17(15)26)12-13-8-7-9-14(20)11-13/h7-9,11H,3-6,10,12H2,1-2H3,(H2,21,22,23)