butyl 4-[2-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[[5-(2-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]amino]benzoic acid butyl ester Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=N3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=N3

InChI

InChI=1S/C20H20N4O4S/c1-2-3-12-27-19(26)14-7-9-15(10-8-14)22-17(25)13-29-20-24-23-18(28-20)16-6-4-5-11-21-16/h4-11H,2-3,12-13H2,1H3,(H,22,25)