6-[[(4-chlorophenyl)amino]methyl]pteridine-2,4-diamine

Systemtic Name: 6-[[(4-chlorophenyl)amino]methyl]pteridine-2,4-diamine Openeye Name: 6-[(4-chloroanilino)methyl]pteridine-2,4-diamine CAS Name: 6-[(4-chloroanilino)methyl]pteridine-2,4-diamine IUPAC Name: 6-[(4-chloroanilino)methyl]pteridine-2,4-diamine Traditional Name: (4-chlorophenyl)-[(2,4-diaminopteridin-6-yl)methyl]amine Formula: C13H12ClN7 MolecularWeight: 301.73428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CN=C3C(=N2)C(=NC(=N3)N)N)Cl

Isomeric SMILES

C1=CC(=CC=C1NCC2=CN=C3C(=N2)C(=NC(=N3)N)N)Cl

InChI

InChI=1S/C13H12ClN7/c14-7-1-3-8(4-2-7)17-5-9-6-18-12-10(19-9)11(15)20-13(16)21-12/h1-4,6,17H,5H2,(H4,15,16,18,20,21)