ethyl 3-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]coumarilic acid ethyl ester Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NN=C(O3)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NN=C(O3)C4=CN=CC=C4

InChI

InChI=1S/C19H15N3O4S/c1-2-24-18(23)16-14(13-7-3-4-8-15(13)25-16)11-27-19-22-21-17(26-19)12-6-5-9-20-10-12/h3-10H,2,11H2,1H3