N-ethyl-5-(7H-purin-6-ylsulfanyl)pentanamide

Systemtic Name: N-ethyl-5-(7H-purin-6-ylsulfanyl)pentanamide Openeye Name: N-ethyl-5-(7H-purin-6-ylsulfanyl)pentanamide CAS Name: N-ethyl-5-(7H-purin-6-ylthio)pentanamide IUPAC Name: N-ethyl-5-(7H-purin-6-ylsulfanyl)pentanamide Traditional Name: N-ethyl-5-(7H-purin-6-ylthio)valeramide Formula: C12H17N5OS MolecularWeight: 279.36128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CCCCSC1=NC=NC2=C1NC=N2

Isomeric SMILES

CCNC(=O)CCCCSC1=NC=NC2=C1NC=N2

InChI

InChI=1S/C12H17N5OS/c1-2-13-9(18)5-3-4-6-19-12-10-11(15-7-14-10)16-8-17-12/h7-8H,2-6H2,1H3,(H,13,18)(H,14,15,16,17)