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8-[(3-bromophenyl)amino]-1,3-dimethyl-7H-purine-2,6-dione

8-[(3-bromophenyl)amino]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name:8-[(3-bromophenyl)amino]-1,3-dimethyl-7H-purine-2,6-dione
Openeye Name:8-(3-bromoanilino)-1,3-dimethyl-7H-purine-2,6-dione
CAS Name:8-(3-bromoanilino)-1,3-dimethyl-7H-purine-2,6-dione
IUPAC Name:8-(3-bromoanilino)-1,3-dimethyl-7H-purine-2,6-dione
Traditional Name:8-(3-bromoanilino)-1,3-dimethyl-7H-purine-2,6-quinone
Formula: C13H12BrN5O2
MolecularWeight: 350.17068
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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NC3=CC(=CC=C3)Br


Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)NC3=CC(=CC=C3)Br


InChI

InChI=1S/C13H12BrN5O2/c1-18-10-9(11(20)19(2)13(18)21)16-12(17-10)15-8-5-3-4-7(14)6-8/h3-6H,1-2H3,(H2,15,16,17)


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