6-ethoxy-8-pent-4-ynyl-N-phenyl-7H-purin-2-amine

Systemtic Name: 6-ethoxy-8-pent-4-ynyl-N-phenyl-7H-purin-2-amine Openeye Name: 6-ethoxy-8-pent-4-ynyl-N-phenyl-7H-purin-2-amine CAS Name: 6-ethoxy-8-pent-4-ynyl-N-phenyl-7H-purin-2-amine IUPAC Name: 6-ethoxy-8-pent-4-ynyl-N-phenyl-7H-purin-2-amine Traditional Name: (6-ethoxy-8-pent-4-ynyl-7H-purin-2-yl)-phenyl-amine Formula: C18H19N5O MolecularWeight: 321.37636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N5O/c1-3-5-7-12-14-20-15-16(21-14)22-18(23-17(15)24-4-2)19-13-10-8-6-9-11-13/h1,6,8-11H,4-5,7,12H2,2H3,(H2,19,20,21,22,23)