ethyl 3-[[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-4-piperidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 3-[[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]isonipecotoyl]amino]benzoic acid ethyl ester Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCN(CC2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C22H24N4O4S/c1-2-29-22(28)16-5-3-6-17(13-16)23-21(27)15-8-10-26(11-9-15)14-19-24-20(25-30-19)18-7-4-12-31-18/h3-7,12-13,15H,2,8-11,14H2,1H3,(H,23,27)