9-[[2-[(2-azanyl-6-chloranyl-purin-9-yl)methyl]phenyl]methyl]-6-chloranyl-purin-2-amine

Systemtic Name: 9-[[2-[(2-azanyl-6-chloranyl-purin-9-yl)methyl]phenyl]methyl]-6-chloranyl-purin-2-amine Openeye Name: 9-[[2-[(2-amino-6-chloro-purin-9-yl)methyl]phenyl]methyl]-6-chloro-purin-2-amine CAS Name: 9-[[2-[(2-amino-6-chloro-9-purinyl)methyl]phenyl]methyl]-6-chloro-2-purinamine IUPAC Name: 9-[[2-[(2-amino-6-chloropurin-9-yl)methyl]phenyl]methyl]-6-chloropurin-2-amine Traditional Name: [9-[2-[(2-amino-6-chloro-purin-9-yl)methyl]benzyl]-6-chloro-purin-2-yl]amine Formula: C18H14Cl2N10 MolecularWeight: 441.27676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C2N=C(N=C3Cl)N)CN4C=NC5=C4N=C(N=C5Cl)N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C2N=C(N=C3Cl)N)CN4C=NC5=C4N=C(N=C5Cl)N

InChI

InChI=1S/C18H14Cl2N10/c19-13-11-15(27-17(21)25-13)29(7-23-11)5-9-3-1-2-4-10(9)6-30-8-24-12-14(20)26-18(22)28-16(12)30/h1-4,7-8H,5-6H2,(H2,21,25,27)(H2,22,26,28)