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

Systemtic Name: 9-(2-methylpropyl)-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Openeye Name: 9-isobutyl-6-(2-pyridylmethylsulfanyl)purin-2-amine CAS Name: 9-(2-methylpropyl)-6-(2-pyridinylmethylthio)-2-purinamine IUPAC Name: 9-(2-methylpropyl)-6-(pyridin-2-ylmethylsulfanyl)purin-2-amine Traditional Name: [9-isobutyl-6-(2-pyridylmethylthio)purin-2-yl]amine Formula: C15H18N6S MolecularWeight: 314.40862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N6S/c1-10(2)7-21-9-18-12-13(21)19-15(16)20-14(12)22-8-11-5-3-4-6-17-11/h3-6,9-10H,7-8H2,1-2H3,(H2,16,19,20)