6-azanyl-2-(butylamino)-9-(pyridin-3-ylmethyl)-7H-purin-8-one

Systemtic Name: 6-azanyl-2-(butylamino)-9-(pyridin-3-ylmethyl)-7H-purin-8-one Openeye Name: 6-amino-2-(butylamino)-9-(3-pyridylmethyl)-7H-purin-8-one CAS Name: 6-amino-2-(butylamino)-9-(3-pyridinylmethyl)-7H-purin-8-one IUPAC Name: 6-amino-2-(butylamino)-9-(pyridin-3-ylmethyl)-7H-purin-8-one Traditional Name: 6-amino-2-(butylamino)-9-(3-pyridylmethyl)-7H-purin-8-one Formula: C15H19N7O MolecularWeight: 313.35766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N7O/c1-2-3-7-18-14-20-12(16)11-13(21-14)22(15(23)19-11)9-10-5-4-6-17-8-10/h4-6,8H,2-3,7,9H2,1H3,(H,19,23)(H3,16,18,20,21)