N-propan-2-yl-N-[2-(7H-purin-6-ylsulfanyl)ethyl]propan-2-amine

Systemtic Name: N-propan-2-yl-N-[2-(7H-purin-6-ylsulfanyl)ethyl]propan-2-amine Openeye Name: N-isopropyl-N-[2-(7H-purin-6-ylsulfanyl)ethyl]propan-2-amine CAS Name: N-propan-2-yl-N-[2-(7H-purin-6-ylthio)ethyl]-2-propanamine IUPAC Name: N-propan-2-yl-N-[2-(7H-purin-6-ylsulfanyl)ethyl]propan-2-amine Traditional Name: diisopropyl-[2-(7H-purin-6-ylthio)ethyl]amine Formula: C13H21N5S MolecularWeight: 279.40434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCSC1=NC=NC2=C1NC=N2)C(C)C

Isomeric SMILES

CC(C)N(CCSC1=NC=NC2=C1NC=N2)C(C)C

InChI

InChI=1S/C13H21N5S/c1-9(2)18(10(3)4)5-6-19-13-11-12(15-7-14-11)16-8-17-13/h7-10H,5-6H2,1-4H3,(H,14,15,16,17)