propan-2-yl 4-chloranyl-3-[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-chloranyl-3-[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: isopropyl 4-chloro-3-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-chloro-3-[[1-oxo-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]ethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-chloro-3-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-[(5-phenyl-1,3,4-oxadiazol-2-yl)thio]acetyl]amino]benzoic acid isopropyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C20H18ClN3O4S/c1-12(2)27-19(26)14-8-9-15(21)16(10-14)22-17(25)11-29-20-24-23-18(28-20)13-6-4-3-5-7-13/h3-10,12H,11H2,1-2H3,(H,22,25)