2-chloranyl-5-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentylsulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentylsulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[5-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]pentylsulfamoyl]benzoic acid CAS Name: 2-chloro-5-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentylsulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pentylsulfamoyl]benzoic acid Traditional Name: 2-chloro-5-[5-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]pentylsulfamoyl]benzoic acid Formula: C18H18ClN3O5S2 MolecularWeight: 455.93562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NOC(=N2)CCCCCNS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C2=NOC(=N2)CCCCCNS(=O)(=O)C3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C18H18ClN3O5S2/c19-14-8-7-12(11-13(14)18(23)24)29(25,26)20-9-3-1-2-6-16-21-17(22-27-16)15-5-4-10-28-15/h4-5,7-8,10-11,20H,1-3,6,9H2,(H,23,24)