2-butylsulfanyl-7H-purine

Systemtic Name: 2-butylsulfanyl-7H-purine Openeye Name: 2-butylsulfanyl-7H-purine CAS Name: 2-(butylthio)-7H-purine IUPAC Name: 2-butylsulfanyl-7H-purine Traditional Name: 2-(butylthio)-7H-purine Formula: C9H12N4S MolecularWeight: 208.28338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC=C2C(=N1)N=CN2

Isomeric SMILES

CCCCSC1=NC=C2C(=N1)N=CN2

InChI

InChI=1S/C9H12N4S/c1-2-3-4-14-9-10-5-7-8(13-9)12-6-11-7/h5-6H,2-4H2,1H3,(H,10,11,12,13)