6-(pyridin-4-ylmethylsulfanyl)-5H-purin-2-amine

Systemtic Name: 6-(pyridin-4-ylmethylsulfanyl)-5H-purin-2-amine Openeye Name: 6-(4-pyridylmethylsulfanyl)-5H-purin-2-amine CAS Name: 6-(pyridin-4-ylmethylthio)-5H-purin-2-amine IUPAC Name: 6-(pyridin-4-ylmethylsulfanyl)-5H-purin-2-amine Traditional Name: [6-(4-pyridylmethylthio)-5H-purin-2-yl]amine Formula: C11H10N6S MolecularWeight: 258.3023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1CSC2=NC(=NC3=NC=NC32)N

Isomeric SMILES

C1=CN=CC=C1CSC2=NC(=NC3=NC=NC32)N

InChI

InChI=1S/C11H10N6S/c12-11-16-9-8(14-6-15-9)10(17-11)18-5-7-1-3-13-4-2-7/h1-4,6,8H,5H2,(H2,12,14,15,16)