9-butyl-6-methoxy-N-(2-methylphenyl)purin-2-amine

Systemtic Name: 9-butyl-6-methoxy-N-(2-methylphenyl)purin-2-amine Openeye Name: 9-butyl-6-methoxy-N-(o-tolyl)purin-2-amine CAS Name: 9-butyl-6-methoxy-N-(2-methylphenyl)-2-purinamine IUPAC Name: 9-butyl-6-methoxy-N-(2-methylphenyl)purin-2-amine Traditional Name: (9-butyl-6-methoxy-purin-2-yl)-(o-tolyl)amine Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OC)NC3=CC=CC=C3C

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OC)NC3=CC=CC=C3C

InChI

InChI=1S/C17H21N5O/c1-4-5-10-22-11-18-14-15(22)20-17(21-16(14)23-3)19-13-9-7-6-8-12(13)2/h6-9,11H,4-5,10H2,1-3H3,(H,19,20,21)