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

Systemtic Name: 2-chloranyl-N-[(3,4-dichlorophenyl)methyl]-9-(3-methoxypropyl)purin-6-amine Openeye Name: 2-chloro-N-[(3,4-dichlorophenyl)methyl]-9-(3-methoxypropyl)purin-6-amine CAS Name: 2-chloro-N-[(3,4-dichlorophenyl)methyl]-9-(3-methoxypropyl)-6-purinamine IUPAC Name: 2-chloro-N-[(3,4-dichlorophenyl)methyl]-9-(3-methoxypropyl)purin-6-amine Traditional Name: [2-chloro-9-(3-methoxypropyl)purin-6-yl]-(3,4-dichlorobenzyl)amine Formula: C16H16Cl3N5O MolecularWeight: 400.69014

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C=NC2=C1N=C(N=C2NCC3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

COCCCN1C=NC2=C1N=C(N=C2NCC3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C16H16Cl3N5O/c1-25-6-2-5-24-9-21-13-14(22-16(19)23-15(13)24)20-8-10-3-4-11(17)12(18)7-10/h3-4,7,9H,2,5-6,8H2,1H3,(H,20,22,23)