8-(naphthalen-2-ylsulfanylmethyl)-7H-purine-2,6-diamine

Systemtic Name: 8-(naphthalen-2-ylsulfanylmethyl)-7H-purine-2,6-diamine Openeye Name: 8-(2-naphthylsulfanylmethyl)-7H-purine-2,6-diamine CAS Name: 8-[(2-naphthalenylthio)methyl]-7H-purine-2,6-diamine IUPAC Name: 8-(naphthalen-2-ylsulfanylmethyl)-7H-purine-2,6-diamine Traditional Name: [2-amino-8-[(2-naphthylthio)methyl]-7H-purin-6-yl]amine Formula: C16H14N6S MolecularWeight: 322.38756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)SCC3=NC4=C(N3)C(=NC(=N4)N)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)SCC3=NC4=C(N3)C(=NC(=N4)N)N

InChI

InChI=1S/C16H14N6S/c17-14-13-15(22-16(18)21-14)20-12(19-13)8-23-11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2,(H5,17,18,19,20,21,22)