[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C22H18N2O3S MolecularWeight: 390.45492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H18N2O3S/c1-15-6-2-5-9-19(15)22-23-20(27-24-22)13-26-21(25)14-28-18-11-10-16-7-3-4-8-17(16)12-18/h2-12H,13-14H2,1H3