6-[[(3,4-dichlorophenyl)amino]methyl]pteridine-2,4-diamine

Systemtic Name: 6-[[(3,4-dichlorophenyl)amino]methyl]pteridine-2,4-diamine Openeye Name: 6-[(3,4-dichloroanilino)methyl]pteridine-2,4-diamine CAS Name: 6-[(3,4-dichloroanilino)methyl]pteridine-2,4-diamine IUPAC Name: 6-[(3,4-dichloroanilino)methyl]pteridine-2,4-diamine Traditional Name: (2,4-diaminopteridin-6-yl)methyl-(3,4-dichlorophenyl)amine Formula: C13H11Cl2N7 MolecularWeight: 336.17934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11Cl2N7/c14-8-2-1-6(3-9(8)15)18-4-7-5-19-12-10(20-7)11(16)21-13(17)22-12/h1-3,5,18H,4H2,(H4,16,17,19,21,22)