6-(phenylazanylmethyl)pteridine-2,4-diamine hydrobromide

Systemtic Name: 6-(phenylazanylmethyl)pteridine-2,4-diamine hydrobromide Openeye Name: 6-(anilinomethyl)pteridine-2,4-diamine hydrobromide CAS Name: 6-(anilinomethyl)pteridine-2,4-diamine hydrobromide IUPAC Name: 6-(anilinomethyl)pteridine-2,4-diamine hydrobromide Traditional Name: (2,4-diaminopteridin-6-yl)methyl-phenyl-amine hydrobromide Formula: C13H14BrN7 MolecularWeight: 348.20116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N.Br

Isomeric SMILES

C1=CC=C(C=C1)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N.Br

InChI

InChI=1S/C13H13N7.BrH/c14-11-10-12(20-13(15)19-11)17-7-9(18-10)6-16-8-4-2-1-3-5-8;/h1-5,7,16H,6H2,(H4,14,15,17,19,20);1H