N6-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethyl]-3-nitro-pyridine-2,6-diamine dihydrochloride

Systemtic Name: N6-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethyl]-3-nitro-pyridine-2,6-diamine dihydrochloride Openeye Name: N6-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethyl]-3-nitro-pyridine-2,6-diamine dihydrochloride CAS Name: N6-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)-2-pyrimidinyl]amino]ethyl]-3-nitropyridine-2,6-diamine dihydrochloride IUPAC Name: 6-N-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethyl]-3-nitropyridine-2,6-diamine dihydrochloride Traditional Name: (6-amino-5-nitro-2-pyridyl)-[2-[[4-(2,4-dichlorophenyl)-5-(5-phenyl-1H-imidazol-2-yl)pyrimidin-2-yl]amino]ethyl]amine dihydrochloride Formula: C26H23Cl4N9O2 MolecularWeight: 635.33192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(N2)C3=CN=C(N=C3C4=C(C=C(C=C4)Cl)Cl)NCCNC5=NC(=C(C=C5)[N+](=O)[O-])N.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CN=C(N2)C3=CN=C(N=C3C4=C(C=C(C=C4)Cl)Cl)NCCNC5=NC(=C(C=C5)[N+](=O)[O-])N.Cl.Cl

InChI

InChI=1S/C26H21Cl2N9O2.2ClH/c27-16-6-7-17(19(28)12-16)23-18(25-32-14-20(34-25)15-4-2-1-3-5-15)13-33-26(36-23)31-11-10-30-22-9-8-21(37(38)39)24(29)35-22;;/h1-9,12-14H,10-11H2,(H,32,34)(H3,29,30,35)(H,31,33,36);2*1H