1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H17N3O3S/c1-14(21-23-20(24-27-21)17-7-4-10-22-12-17)26-19(25)13-28-18-9-8-15-5-2-3-6-16(15)11-18/h2-12,14H,13H2,1H3