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

Systemtic Name: butyl 4-[[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidin-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidinyl]methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]nipecotoyl]amino]benzoic acid butyl ester Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C24H28N4O4S/c1-2-3-13-31-24(30)17-8-10-19(11-9-17)25-23(29)18-6-4-12-28(15-18)16-21-26-22(27-32-21)20-7-5-14-33-20/h5,7-11,14,18H,2-4,6,12-13,15-16H2,1H3,(H,25,29)