6-azanyl-2-(butylamino)-9-(pyrazin-2-ylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(butylamino)-9-(pyrazin-2-ylmethyl)-7H-purin-8-one Openeye Name: 6-amino-2-(butylamino)-9-(pyrazin-2-ylmethyl)-7H-purin-8-one CAS Name: 6-amino-2-(butylamino)-9-(2-pyrazinylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(butylamino)-9-(pyrazin-2-ylmethyl)-7H-purin-8-one Traditional Name: 6-amino-2-(butylamino)-9-(pyrazin-2-ylmethyl)-7H-purin-8-one Formula: C14H18N8O MolecularWeight: 314.34572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)NC(=O)N2CC3=NC=CN=C3

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)NC(=O)N2CC3=NC=CN=C3

InChI

InChI=1S/C14H18N8O/c1-2-3-4-18-13-20-11(15)10-12(21-13)22(14(23)19-10)8-9-7-16-5-6-17-9/h5-7H,2-4,8H2,1H3,(H,19,23)(H3,15,18,20,21)