2-naphthalen-2-ylsulfanyl-9-(phenylmethyl)purin-6-amine

Systemtic Name: 2-naphthalen-2-ylsulfanyl-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-2-(2-naphthylsulfanyl)purin-6-amine CAS Name: 2-(2-naphthalenylthio)-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-2-naphthalen-2-ylsulfanylpurin-6-amine Traditional Name: [9-benzyl-2-(2-naphthylthio)purin-6-yl]amine Formula: C22H17N5S MolecularWeight: 383.46888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3N)SC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3N)SC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H17N5S/c23-20-19-21(27(14-24-19)13-15-6-2-1-3-7-15)26-22(25-20)28-18-11-10-16-8-4-5-9-17(16)12-18/h1-12,14H,13H2,(H2,23,25,26)