(3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C21H16N2O3S MolecularWeight: 376.42834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16N2O3S/c24-20(14-27-18-11-10-15-6-4-5-9-17(15)12-18)25-13-19-22-21(23-26-19)16-7-2-1-3-8-16/h1-12H,13-14H2