2-[[3,4-bis(bromanyl)phenyl]amino]-3,7-dihydropurin-6-one

Systemtic Name: 2-[[3,4-bis(bromanyl)phenyl]amino]-3,7-dihydropurin-6-one Openeye Name: 2-(3,4-dibromoanilino)-3,7-dihydropurin-6-one CAS Name: 2-(3,4-dibromoanilino)-3,7-dihydropurin-6-one IUPAC Name: 2-(3,4-dibromoanilino)-3,7-dihydropurin-6-one Traditional Name: 2-(3,4-dibromoanilino)-3,7-dihydropurin-6-one Formula: C11H7Br2N5O MolecularWeight: 385.01418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC(=O)C3=C(N2)N=CN3)Br)Br

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC(=O)C3=C(N2)N=CN3)Br)Br

InChI

InChI=1S/C11H7Br2N5O/c12-6-2-1-5(3-7(6)13)16-11-17-9-8(10(19)18-11)14-4-15-9/h1-4H,(H3,14,15,16,17,18,19)