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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)CC3=NC(=NO3)C4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2CCCN(C2)CC3=NC(=NO3)C4=CC=CS4)C(=O)OC

InChI

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