N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phthalazine-1,4,6-triamine

Systemtic Name: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phthalazine-1,4,6-triamine Openeye Name: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phthalazine-1,4,6-triamine CAS Name: N1,N4-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phthalazine-1,4,6-triamine IUPAC Name: 1-N,4-N-bis[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]phthalazine-1,4,6-triamine Traditional Name: [6-amino-4-[4-(2-imidazolin-2-yl)anilino]phthalazin-1-yl]-[4-(2-imidazolin-2-yl)phenyl]amine Formula: C26H25N9 MolecularWeight: 463.537

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)C2=CC=C(C=C2)NC3=NN=C(C4=C3C=CC(=C4)N)NC5=CC=C(C=C5)C6=NCCN6

Isomeric SMILES

C1CN=C(N1)C2=CC=C(C=C2)NC3=NN=C(C4=C3C=CC(=C4)N)NC5=CC=C(C=C5)C6=NCCN6

InChI

InChI=1S/C26H25N9/c27-18-5-10-21-22(15-18)26(33-20-8-3-17(4-9-20)24-30-13-14-31-24)35-34-25(21)32-19-6-1-16(2-7-19)23-28-11-12-29-23/h1-10,15H,11-14,27H2,(H,28,29)(H,30,31)(H,32,34)(H,33,35)