8-(2-azanyl-4-chloranyl-phenyl)-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-(2-azanyl-4-chloranyl-phenyl)-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(2-amino-4-chloro-phenyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(2-amino-4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(2-amino-4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(2-amino-4-chloro-phenyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C13H12ClN5O2 MolecularWeight: 305.71968

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=C(C=C3)Cl)N

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=C(C=C3)Cl)N

InChI

InChI=1S/C13H12ClN5O2/c1-18-11-9(12(20)19(2)13(18)21)16-10(17-11)7-4-3-6(14)5-8(7)15/h3-5H,15H2,1-2H3,(H,16,17)