6-ethoxy-N-(4-fluorophenyl)-8-pent-4-ynyl-7H-purin-2-amine

Systemtic Name: 6-ethoxy-N-(4-fluorophenyl)-8-pent-4-ynyl-7H-purin-2-amine Openeye Name: 6-ethoxy-N-(4-fluorophenyl)-8-pent-4-ynyl-7H-purin-2-amine CAS Name: 6-ethoxy-N-(4-fluorophenyl)-8-pent-4-ynyl-7H-purin-2-amine IUPAC Name: 6-ethoxy-N-(4-fluorophenyl)-8-pent-4-ynyl-7H-purin-2-amine Traditional Name: (6-ethoxy-8-pent-4-ynyl-7H-purin-2-yl)-(4-fluorophenyl)amine Formula: C18H18FN5O MolecularWeight: 339.366823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC2=C1NC(=N2)CCCC#C)NC3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=NC(=NC2=C1NC(=N2)CCCC#C)NC3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN5O/c1-3-5-6-7-14-21-15-16(22-14)23-18(24-17(15)25-4-2)20-13-10-8-12(19)9-11-13/h1,8-11H,4-7H2,2H3,(H2,20,21,22,23,24)