methyl 4-[[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]methyl]benzoic acid methyl ester Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C(=O)OC(=N2)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C(=O)OC(=N2)C3=CC=CS3

InChI

InChI=1S/C17H15N3O5S/c1-24-16(22)12-6-4-11(5-7-12)9-18-14(21)10-20-17(23)25-15(19-20)13-3-2-8-26-13/h2-8H,9-10H2,1H3,(H,18,21)