6-(naphthalen-1-ylmethylsulfanyl)-7H-purin-2-amine

Systemtic Name: 6-(naphthalen-1-ylmethylsulfanyl)-7H-purin-2-amine Openeye Name: 6-(1-naphthylmethylsulfanyl)-7H-purin-2-amine CAS Name: 6-(1-naphthalenylmethylthio)-7H-purin-2-amine IUPAC Name: 6-(naphthalen-1-ylmethylsulfanyl)-7H-purin-2-amine Traditional Name: [6-(1-naphthylmethylthio)-7H-purin-2-yl]amine Formula: C16H13N5S MolecularWeight: 307.37292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NC(=NC4=C3NC=N4)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NC(=NC4=C3NC=N4)N

InChI

InChI=1S/C16H13N5S/c17-16-20-14-13(18-9-19-14)15(21-16)22-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,9H,8H2,(H3,17,18,19,20,21)