1-naphthalen-2-yl-2-(7H-purin-6-ylsulfanyl)ethanone

Systemtic Name: 1-naphthalen-2-yl-2-(7H-purin-6-ylsulfanyl)ethanone Openeye Name: 1-(2-naphthyl)-2-(7H-purin-6-ylsulfanyl)ethanone CAS Name: 1-(2-naphthalenyl)-2-(7H-purin-6-ylthio)ethanone IUPAC Name: 1-naphthalen-2-yl-2-(7H-purin-6-ylsulfanyl)ethanone Traditional Name: 1-(2-naphthyl)-2-(7H-purin-6-ylthio)ethanone Formula: C17H12N4OS MolecularWeight: 320.36838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)CSC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H12N4OS/c22-14(13-6-5-11-3-1-2-4-12(11)7-13)8-23-17-15-16(19-9-18-15)20-10-21-17/h1-7,9-10H,8H2,(H,18,19,20,21)