9-butyl-2-chloranyl-N-[(3,4-dichlorophenyl)methyl]purin-6-amine

Systemtic Name: 9-butyl-2-chloranyl-N-[(3,4-dichlorophenyl)methyl]purin-6-amine Openeye Name: 9-butyl-2-chloro-N-[(3,4-dichlorophenyl)methyl]purin-6-amine CAS Name: 9-butyl-2-chloro-N-[(3,4-dichlorophenyl)methyl]-6-purinamine IUPAC Name: 9-butyl-2-chloro-N-[(3,4-dichlorophenyl)methyl]purin-6-amine Traditional Name: (9-butyl-2-chloro-purin-6-yl)-(3,4-dichlorobenzyl)amine Formula: C16H16Cl3N5 MolecularWeight: 384.69074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2NCC3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2NCC3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C16H16Cl3N5/c1-2-3-6-24-9-21-13-14(22-16(19)23-15(13)24)20-8-10-4-5-11(17)12(18)7-10/h4-5,7,9H,2-3,6,8H2,1H3,(H,20,22,23)