2-butyl-9-methyl-8-(1,2,3-triazol-2-yl)purin-6-amine

Systemtic Name: 2-butyl-9-methyl-8-(1,2,3-triazol-2-yl)purin-6-amine Openeye Name: 2-butyl-9-methyl-8-(triazol-2-yl)purin-6-amine CAS Name: 2-butyl-9-methyl-8-(2-triazolyl)-6-purinamine IUPAC Name: 2-butyl-9-methyl-8-(triazol-2-yl)purin-6-amine Traditional Name: [2-butyl-9-methyl-8-(triazol-2-yl)purin-6-yl]amine Formula: C12H16N8 MolecularWeight: 272.30904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)N)N=C(N2C)N3N=CC=N3

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)N)N=C(N2C)N3N=CC=N3

InChI

InChI=1S/C12H16N8/c1-3-4-5-8-16-10(13)9-11(17-8)19(2)12(18-9)20-14-6-7-15-20/h6-7H,3-5H2,1-2H3,(H2,13,16,17)