4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 2-methoxybenzoate

Systemtic Name: 4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 2-methoxybenzoate Openeye Name: 4-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester IUPAC Name: 4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid 4-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester Formula: C24H18N2O4S MolecularWeight: 430.47572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)OCC#CCSC2=NN=C(O2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC=C1C(=O)OCC#CCSC2=NN=C(O2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H18N2O4S/c1-28-21-14-5-4-12-20(21)23(27)29-15-6-7-16-31-24-26-25-22(30-24)19-13-8-10-17-9-2-3-11-18(17)19/h2-5,8-14H,15-16H2,1H3