6-(methylamino)-7-(phenylmethyl)-3H-purine-2-thione

Systemtic Name: 6-(methylamino)-7-(phenylmethyl)-3H-purine-2-thione Openeye Name: 7-benzyl-6-(methylamino)-3H-purine-2-thione CAS Name: 6-(methylamino)-7-(phenylmethyl)-3H-purine-2-thione IUPAC Name: 7-benzyl-6-(methylamino)-3H-purine-2-thione Traditional Name: 7-benzyl-6-(methylamino)-3H-purine-2-thione Formula: C13H13N5S MolecularWeight: 271.34082

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=S)NC2=C1N(C=N2)CC3=CC=CC=C3

Isomeric SMILES

CNC1=NC(=S)NC2=C1N(C=N2)CC3=CC=CC=C3

InChI

InChI=1S/C13H13N5S/c1-14-11-10-12(17-13(19)16-11)15-8-18(10)7-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H2,14,16,17,19)