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

Systemtic Name: 9-butyl-6-(1,2,4-triazol-4-yl)purine Openeye Name: 9-butyl-6-(1,2,4-triazol-4-yl)purine CAS Name: 9-butyl-6-(1,2,4-triazol-4-yl)purine IUPAC Name: 9-butyl-6-(1,2,4-triazol-4-yl)purine Traditional Name: 9-butyl-6-(1,2,4-triazol-4-yl)purine Formula: C11H13N7 MolecularWeight: 243.26782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=CN=C2N3C=NN=C3

Isomeric SMILES

CCCCN1C=NC2=C1N=CN=C2N3C=NN=C3

InChI

InChI=1S/C11H13N7/c1-2-3-4-17-6-14-9-10(17)12-5-13-11(9)18-7-15-16-8-18/h5-8H,2-4H2,1H3