7-(4-bromophenyl)-1,3-dimethyl-5-oxidanidyl-2,4-dihydropteridin-5-ium

Systemtic Name: 7-(4-bromophenyl)-1,3-dimethyl-5-oxidanidyl-2,4-dihydropteridin-5-ium Openeye Name: 7-(4-bromophenyl)-1,3-dimethyl-5-oxido-2,4-dihydropteridin-5-ium CAS Name: 7-(4-bromophenyl)-1,3-dimethyl-5-oxido-2,4-dihydropteridin-5-ium IUPAC Name: 7-(4-bromophenyl)-1,3-dimethyl-5-oxido-2,4-dihydropteridin-5-ium Traditional Name: 7-(4-bromophenyl)-1,3-dimethyl-5-oxido-2,4-dihydropteridin-5-ium Formula: C14H15BrN4O MolecularWeight: 335.1991

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=[N+](C=C(N=C2N(C1)C)C3=CC=C(C=C3)Br)[O-]

Isomeric SMILES

CN1CC2=[N+](C=C(N=C2N(C1)C)C3=CC=C(C=C3)Br)[O-]

InChI

InChI=1S/C14H15BrN4O/c1-17-8-13-14(18(2)9-17)16-12(7-19(13)20)10-3-5-11(15)6-4-10/h3-7H,8-9H2,1-2H3