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

Systemtic Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid (3-isopropyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)COC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)C1=NOC(=N1)COC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H18N2O3S/c1-12(2)18-19-16(23-20-18)10-22-17(21)11-24-15-8-7-13-5-3-4-6-14(13)9-15/h3-9,12H,10-11H2,1-2H3