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

Systemtic Name: 9-cyclopentyl-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Openeye Name: 9-cyclopentyl-6-(2-pyridylmethylsulfanyl)purin-2-amine CAS Name: 9-cyclopentyl-6-(2-pyridinylmethylthio)-2-purinamine IUPAC Name: 9-cyclopentyl-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Traditional Name: [9-cyclopentyl-6-(2-pyridylmethylthio)purin-2-yl]amine Formula: C16H18N6S MolecularWeight: 326.41932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C=NC3=C2N=C(N=C3SCC4=CC=CC=N4)N

Isomeric SMILES

C1CCC(C1)N2C=NC3=C2N=C(N=C3SCC4=CC=CC=N4)N

InChI

InChI=1S/C16H18N6S/c17-16-20-14-13(19-10-22(14)12-6-1-2-7-12)15(21-16)23-9-11-5-3-4-8-18-11/h3-5,8,10,12H,1-2,6-7,9H2,(H2,17,20,21)