N4-[6-[5,6-bis(chloranyl)benzimidazol-1-yl]-7H-purin-2-yl]cyclohexane-1,4-diamine

Systemtic Name: N4-[6-[5,6-bis(chloranyl)benzimidazol-1-yl]-7H-purin-2-yl]cyclohexane-1,4-diamine Openeye Name: N4-[6-(5,6-dichlorobenzimidazol-1-yl)-7H-purin-2-yl]cyclohexane-1,4-diamine CAS Name: N4-[6-(5,6-dichloro-1-benzimidazolyl)-7H-purin-2-yl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[6-(5,6-dichlorobenzimidazol-1-yl)-7H-purin-2-yl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-[6-(5,6-dichlorobenzimidazol-1-yl)-7H-purin-2-yl]amine Formula: C18H18Cl2N8 MolecularWeight: 417.29512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC2=NC3=C(C(=N2)N4C=NC5=CC(=C(C=C54)Cl)Cl)NC=N3

Isomeric SMILES

C1CC(CCC1N)NC2=NC3=C(C(=N2)N4C=NC5=CC(=C(C=C54)Cl)Cl)NC=N3

InChI

InChI=1S/C18H18Cl2N8/c19-11-5-13-14(6-12(11)20)28(8-24-13)17-15-16(23-7-22-15)26-18(27-17)25-10-3-1-9(21)2-4-10/h5-10H,1-4,21H2,(H2,22,23,25,26,27)