methyl 3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 3-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoate CAS Name: 3-[[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC2=NN=C(O2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC2=NN=C(O2)C3=CC=NC=C3

InChI

InChI=1S/C16H13N3O3S/c1-21-15(20)13-4-2-3-11(9-13)10-23-16-19-18-14(22-16)12-5-7-17-8-6-12/h2-9H,10H2,1H3