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

Systemtic Name: methyl 2-chloranyl-5-[2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 2-chloro-5-[[1-oxo-2-[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetyl]amino]benzoic acid methyl ester Formula: C17H13ClN4O4S MolecularWeight: 404.82752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O4S/c1-25-16(24)12-7-11(4-5-13(12)18)20-14(23)9-27-17-22-21-15(26-17)10-3-2-6-19-8-10/h2-8H,9H2,1H3,(H,20,23)