2-[(2-azanyl-7H-purin-6-yl)sulfanyl]-1-(4-bromanylcyclohexyl)ethanone

Systemtic Name: 2-[(2-azanyl-7H-purin-6-yl)sulfanyl]-1-(4-bromanylcyclohexyl)ethanone Openeye Name: 2-[(2-amino-7H-purin-6-yl)sulfanyl]-1-(4-bromocyclohexyl)ethanone CAS Name: 2-[(2-amino-7H-purin-6-yl)thio]-1-(4-bromocyclohexyl)ethanone IUPAC Name: 2-[(2-amino-7H-purin-6-yl)sulfanyl]-1-(4-bromocyclohexyl)ethanone Traditional Name: 2-[(2-amino-7H-purin-6-yl)thio]-1-(4-bromocyclohexyl)ethanone Formula: C13H16BrN5OS MolecularWeight: 370.26804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)CSC2=NC(=NC3=C2NC=N3)N)Br

Isomeric SMILES

C1CC(CCC1C(=O)CSC2=NC(=NC3=C2NC=N3)N)Br

InChI

InChI=1S/C13H16BrN5OS/c14-8-3-1-7(2-4-8)9(20)5-21-12-10-11(17-6-16-10)18-13(15)19-12/h6-8H,1-5H2,(H3,15,16,17,18,19)