9-(2-methylbutyl)-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine

Systemtic Name: 9-(2-methylbutyl)-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Openeye Name: 9-(2-methylbutyl)-6-(2-pyridylmethylsulfanyl)purin-2-amine CAS Name: 9-(2-methylbutyl)-6-(2-pyridinylmethylthio)-2-purinamine IUPAC Name: 9-(2-methylbutyl)-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Traditional Name: [9-(2-methylbutyl)-6-(2-pyridylmethylthio)purin-2-yl]amine Formula: C16H20N6S MolecularWeight: 328.4352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1C=NC2=C1N=C(N=C2SCC3=CC=CC=N3)N

Isomeric SMILES

CCC(C)CN1C=NC2=C1N=C(N=C2SCC3=CC=CC=N3)N

InChI

InChI=1S/C16H20N6S/c1-3-11(2)8-22-10-19-13-14(22)20-16(17)21-15(13)23-9-12-6-4-5-7-18-12/h4-7,10-11H,3,8-9H2,1-2H3,(H2,17,20,21)