ethyl 2-(6-naphthalen-2-ylsulfanylpurin-9-yl)ethanoate

Systemtic Name: ethyl 2-(6-naphthalen-2-ylsulfanylpurin-9-yl)ethanoate Openeye Name: ethyl 2-[6-(2-naphthylsulfanyl)purin-9-yl]acetate CAS Name: 2-[6-(2-naphthalenylthio)-9-purinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-naphthalen-2-ylsulfanylpurin-9-yl)acetate Traditional Name: 2-[6-(2-naphthylthio)purin-9-yl]acetic acid ethyl ester Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=NC2=C1N=CN=C2SC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)CN1C=NC2=C1N=CN=C2SC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H16N4O2S/c1-2-25-16(24)10-23-12-22-17-18(23)20-11-21-19(17)26-15-8-7-13-5-3-4-6-14(13)9-15/h3-9,11-12H,2,10H2,1H3