6-[[(4-chloranyl-2-ethyl-phenyl)amino]methyl]pteridine-2,4-diamine

Systemtic Name: 6-[[(4-chloranyl-2-ethyl-phenyl)amino]methyl]pteridine-2,4-diamine Openeye Name: 6-[(4-chloro-2-ethyl-anilino)methyl]pteridine-2,4-diamine CAS Name: 6-[(4-chloro-2-ethylanilino)methyl]pteridine-2,4-diamine IUPAC Name: 6-[(4-chloro-2-ethylanilino)methyl]pteridine-2,4-diamine Traditional Name: (4-chloro-2-ethyl-phenyl)-[(2,4-diaminopteridin-6-yl)methyl]amine Formula: C15H16ClN7 MolecularWeight: 329.78744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Cl)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N

Isomeric SMILES

CCC1=C(C=CC(=C1)Cl)NCC2=CN=C3C(=N2)C(=NC(=N3)N)N

InChI

InChI=1S/C15H16ClN7/c1-2-8-5-9(16)3-4-11(8)19-6-10-7-20-14-12(21-10)13(17)22-15(18)23-14/h3-5,7,19H,2,6H2,1H3,(H4,17,18,20,22,23)