N2-butyl-9-(pyrazin-2-ylmethyl)purine-2,6-diamine

Systemtic Name: N2-butyl-9-(pyrazin-2-ylmethyl)purine-2,6-diamine Openeye Name: N2-butyl-9-(pyrazin-2-ylmethyl)purine-2,6-diamine CAS Name: N2-butyl-9-(2-pyrazinylmethyl)purine-2,6-diamine IUPAC Name: 2-N-butyl-9-(pyrazin-2-ylmethyl)purine-2,6-diamine Traditional Name: [6-amino-9-(pyrazin-2-ylmethyl)purin-2-yl]-butyl-amine Formula: C14H18N8 MolecularWeight: 298.34632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)N=CN2CC3=NC=CN=C3

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)N=CN2CC3=NC=CN=C3

InChI

InChI=1S/C14H18N8/c1-2-3-4-18-14-20-12(15)11-13(21-14)22(9-19-11)8-10-7-16-5-6-17-10/h5-7,9H,2-4,8H2,1H3,(H3,15,18,20,21)