9-octan-2-yl-6-(1,2,4-triazol-4-yl)purine

Systemtic Name: 9-octan-2-yl-6-(1,2,4-triazol-4-yl)purine Openeye Name: 9-(1-methylheptyl)-6-(1,2,4-triazol-4-yl)purine CAS Name: 9-octan-2-yl-6-(1,2,4-triazol-4-yl)purine IUPAC Name: 9-octan-2-yl-6-(1,2,4-triazol-4-yl)purine Traditional Name: 9-(1-methylheptyl)-6-(1,2,4-triazol-4-yl)purine Formula: C15H21N7 MolecularWeight: 299.37414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)N1C=NC2=C1N=CN=C2N3C=NN=C3

Isomeric SMILES

CCCCCCC(C)N1C=NC2=C1N=CN=C2N3C=NN=C3

InChI

InChI=1S/C15H21N7/c1-3-4-5-6-7-12(2)22-9-18-13-14(16-8-17-15(13)22)21-10-19-20-11-21/h8-12H,3-7H2,1-2H3