2-chloranyl-9-cyclopentyl-N-[(3-methylphenyl)methyl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[(3-methylphenyl)methyl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-(m-tolylmethyl)purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[(3-methylphenyl)methyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[(3-methylphenyl)methyl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-(3-methylbenzyl)amine Formula: C18H20ClN5 MolecularWeight: 341.8379

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)CNC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

InChI

InChI=1S/C18H20ClN5/c1-12-5-4-6-13(9-12)10-20-16-15-17(23-18(19)22-16)24(11-21-15)14-7-2-3-8-14/h4-6,9,11,14H,2-3,7-8,10H2,1H3,(H,20,22,23)