9-butyl-N-(4-fluorophenyl)-6-methoxy-purin-2-amine

Systemtic Name: 9-butyl-N-(4-fluorophenyl)-6-methoxy-purin-2-amine Openeye Name: 9-butyl-N-(4-fluorophenyl)-6-methoxy-purin-2-amine CAS Name: 9-butyl-N-(4-fluorophenyl)-6-methoxy-2-purinamine IUPAC Name: 9-butyl-N-(4-fluorophenyl)-6-methoxypurin-2-amine Traditional Name: (9-butyl-6-methoxy-purin-2-yl)-(4-fluorophenyl)amine Formula: C16H18FN5O MolecularWeight: 315.345423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2OC)NC3=CC=C(C=C3)F

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2OC)NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN5O/c1-3-4-9-22-10-18-13-14(22)20-16(21-15(13)23-2)19-12-7-5-11(17)6-8-12/h5-8,10H,3-4,9H2,1-2H3,(H,19,20,21)