6-methoxy-9-(3-methylbutyl)-N-phenyl-purin-2-amine

Systemtic Name: 6-methoxy-9-(3-methylbutyl)-N-phenyl-purin-2-amine Openeye Name: 9-isopentyl-6-methoxy-N-phenyl-purin-2-amine CAS Name: 6-methoxy-9-(3-methylbutyl)-N-phenyl-2-purinamine IUPAC Name: 6-methoxy-9-(3-methylbutyl)-N-phenylpurin-2-amine Traditional Name: (9-isoamyl-6-methoxy-purin-2-yl)-phenyl-amine Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=NC2=C1N=C(N=C2OC)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN1C=NC2=C1N=C(N=C2OC)NC3=CC=CC=C3

InChI

InChI=1S/C17H21N5O/c1-12(2)9-10-22-11-18-14-15(22)20-17(21-16(14)23-3)19-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,19,20,21)