N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]purine-2,6-diamine

Systemtic Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]purine-2,6-diamine Openeye Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]purine-2,6-diamine CAS Name: N6-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]purine-2,6-diamine IUPAC Name: 6-N-(3-aminophenyl)-9-[2-(4-aminophenyl)ethyl]purine-2,6-diamine Traditional Name: [2-amino-9-[2-(4-aminophenyl)ethyl]purin-6-yl]-(3-aminophenyl)amine Formula: C19H20N8 MolecularWeight: 360.4157

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=NC3=C2N=CN3CCC4=CC=C(C=C4)N)N)N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=NC3=C2N=CN3CCC4=CC=C(C=C4)N)N)N

InChI

InChI=1S/C19H20N8/c20-13-6-4-12(5-7-13)8-9-27-11-23-16-17(25-19(22)26-18(16)27)24-15-3-1-2-14(21)10-15/h1-7,10-11H,8-9,20-21H2,(H3,22,24,25,26)