2-chloranyl-N-[(4-methoxyphenyl)methyl]-9-propyl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[(4-methoxyphenyl)methyl]-9-propyl-purin-6-amine Openeye Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-propyl-purin-6-amine CAS Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-propyl-6-purinamine IUPAC Name: 2-chloro-N-[(4-methoxyphenyl)methyl]-9-propylpurin-6-amine Traditional Name: (2-chloro-9-propyl-purin-6-yl)-p-anisyl-amine Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CCCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C16H18ClN5O/c1-3-8-22-10-19-13-14(20-16(17)21-15(13)22)18-9-11-4-6-12(23-2)7-5-11/h4-7,10H,3,8-9H2,1-2H3,(H,18,20,21)