6-chloranyl-7-[[4-(chloromethyl)phenyl]methyl]purin-2-amine

Systemtic Name: 6-chloranyl-7-[[4-(chloromethyl)phenyl]methyl]purin-2-amine Openeye Name: 6-chloro-7-[[4-(chloromethyl)phenyl]methyl]purin-2-amine CAS Name: 6-chloro-7-[[4-(chloromethyl)phenyl]methyl]-2-purinamine IUPAC Name: 6-chloro-7-[[4-(chloromethyl)phenyl]methyl]purin-2-amine Traditional Name: [6-chloro-7-[4-(chloromethyl)benzyl]purin-2-yl]amine Formula: C13H11Cl2N5 MolecularWeight: 308.16594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C2C(=NC(=N3)N)Cl)CCl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C2C(=NC(=N3)N)Cl)CCl

InChI

InChI=1S/C13H11Cl2N5/c14-5-8-1-3-9(4-2-8)6-20-7-17-12-10(20)11(15)18-13(16)19-12/h1-4,7H,5-6H2,(H2,16,18,19)